1-tert-butyl-4-(2,2-dimethylpropyl)benzene;1-tert-butyl-4-(2,2-dimethylpropyl)cyclohexane;1-tert-butyl-4-(2,2-dimethylpropyl)-3,6-dihydro-2H-pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)piperazine;1-tert-butyl-4-(2,2-dimethylpropyl)piperidine;4-tert-butyl-1-(2,2-dimethylpropyl)piperidine;1-tert-butyl-4-(2,2-dimethylpropyl)pyrazole;2-tert-butyl-5-(2,2-dimethylpropyl)pyridine;5-tert-butyl-2-(2,2-dimethylpropyl)pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)pyridin-1-ium;2-tert-butyl-5-(2,2-dimethylpropyl)pyrimidine;4-(2,2-dimethylpropyl)morpholine;4-(2,2-dimethylpropyl)oxane;4-(2,2-dimethylpropyl)-1,4-thiazinane 1,1-dioxide;4-(2,2-dimethylpropyl)-1,4-thiazinane 1-oxide;4-(2,2-dimethylpropyl)thiomorpholine

C198H377N16O5S3+ — CID 159178818

IUPAC1-tert-butyl-4-(2,2-dimethylpropyl)benzene;1-tert-butyl-4-(2,2-dimethylpropyl)cyclohexane;1-tert-butyl-4-(2,2-dimethylpropyl)-3,6-dihydro-2H-pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)piperazine;1-tert-butyl-4-(2,2-dimethylpropyl)piperidine;4-tert-butyl-1-(2,2-dimethylpropyl)piperidine;1-tert-butyl-4-(2,2-dimethylpropyl)pyrazole;2-tert-butyl-5-(2,2-dimethylpropyl)pyridine;5-tert-butyl-2-(2,2-dimethylpropyl)pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)pyridin-1-ium;2-tert-butyl-5-(2,2-dimethylpropyl)pyrimidine;4-(2,2-dimethylpropyl)morpholine;4-(2,2-dimethylpropyl)oxane;4-(2,2-dimethylpropyl)-1,4-thiazinane 1,1-dioxide;4-(2,2-dimethylpropyl)-1,4-thiazinane 1-oxide;4-(2,2-dimethylpropyl)thiomorpholine
SMILESCC(C)(C)CC1=CCN(C(C)(C)C)CC1.CC(C)(C)CC1CCC(C(C)(C)C)CC1.CC(C)(C)CC1CCN(C(C)(C)C)CC1.CC(C)(C)CC1CCOCC1.CC(C)(C)CN1CCC(C(C)(C)C)CC1.CC(C)(C)CN1CCN(C(C)(C)C)CC1.CC(C)(C)CN1CCOCC1.CC(C)(C)CN1CCS(=O)(=O)CC1.CC(C)(C)CN1CCS(=O)CC1.CC(C)(C)CN1CCSCC1.CC(C)(C)Cc1cc[n+](C(C)(C)C)cc1.CC(C)(C)Cc1ccc(C(C)(C)C)cc1.CC(C)(C)Cc1ccc(C(C)(C)C)cn1.CC(C)(C)Cc1ccc(C(C)(C)C)nc1.CC(C)(C)Cc1cnc(C(C)(C)C)nc1.CC(C)(C)Cc1cnn(C(C)(C)C)c1
InChIInChI=1S/C15H30.C15H24.2C14H29N.C14H27N.C14H24N.2C14H23N.C13H22N2.C13H28N2.C12H22N2.C10H20O.C9H19NO2S.C9H19NOS.C9H19NO.C9H19NS/c2*1-14(2,3)11-12-7-9-13(10-8-12)15(4,5)6;1-13(2,3)11-15-9-7-12(8-10-15)14(4,5)6;3*1-13(2,3)11-12-7-9-15(10-8-12)14(4,5)6;1-13(2,3)9-12-8-7-11(10-15-12)14(4,5)6;1-13(2,3)9-11-7-8-12(15-10-11)14(4,5)6;1-12(2,3)7-10-8-14-11(15-9-10)13(4,5)6;1-12(2,3)11-14-7-9-15(10-8-14)13(4,5)6;1-11(2,3)7-10-8-13-14(9-10)12(4,5)6;1-10(2,3)8-9-4-6-11-7-5-9;1-9(2,3)8-10-4-6-13(11,12)7-5-10;1-9(2,3)8-10-4-6-12(11)7-5-10;2*1-9(2,3)8-10-4-6-11-7-5-10/h12-13H,7-11H2,1-6H3;7-10H,11H2,1-6H3;2*12H,7-11H2,1-6H3;7H,8-11H2,1-6H3;7-10H,11H2,1-6H3;2*7-8,10H,9H2,1-6H3;8-9H,7H2,1-6H3;7-11H2,1-6H3;8-9H,7H2,1-6H3;9H,4-8H2,1-3H3;4-8H2,1-3H3;4-8H2,1-3H3;2*4-8H2,1-3H3/q;;;;;+1;;;;;;;;;;
InChIKeyWCOYWQGSBFIRJN-UHFFFAOYSA-N
MW3158.50 g/mol
LogP49.87
Rot. Bonds16

About 1-tert-butyl-4-(2,2-dimethylpropyl)benzene;1-tert-butyl-4-(2,2-dimethylpropyl)cyclohexane;1-tert-butyl-4-(2,2-dimethylpropyl)-3,6-dihydro-2H-pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)piperazine;1-tert-butyl-4-(2,2-dimethylpropyl)piperidine;4-tert-butyl-1-(2,2-dimethylpropyl)piperidine;1-tert-butyl-4-(2,2-dimethylpropyl)pyrazole;2-tert-butyl-5-(2,2-dimethylpropyl)pyridine;5-tert-butyl-2-(2,2-dimethylpropyl)pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)pyridin-1-ium;2-tert-butyl-5-(2,2-dimethylpropyl)pyrimidine;4-(2,2-dimethylpropyl)morpholine;4-(2,2-dimethylpropyl)oxane;4-(2,2-dimethylpropyl)-1,4-thiazinane 1,1-dioxide;4-(2,2-dimethylpropyl)-1,4-thiazinane 1-oxide;4-(2,2-dimethylpropyl)thiomorpholine

1-tert-butyl-4-(2,2-dimethylpropyl)benzene;1-tert-butyl-4-(2,2-dimethylpropyl)cyclohexane;1-tert-butyl-4-(2,2-dimethylpropyl)-3,6-dihydro-2H-pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)piperazine;1-tert-butyl-4-(2,2-dimethylpropyl)piperidine;4-tert-butyl-1-(2,2-dimethylpropyl)piperidine;1-tert-butyl-4-(2,2-dimethylpropyl)pyrazole;2-tert-butyl-5-(2,2-dimethylpropyl)pyridine;5-tert-butyl-2-(2,2-dimethylpropyl)pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)pyridin-1-ium;2-tert-butyl-5-(2,2-dimethylpropyl)pyrimidine;4-(2,2-dimethylpropyl)morpholine;4-(2,2-dimethylpropyl)oxane;4-(2,2-dimethylpropyl)-1,4-thiazinane 1,1-dioxide;4-(2,2-dimethylpropyl)-1,4-thiazinane 1-oxide;4-(2,2-dimethylpropyl)thiomorpholine (PubChem CID 159178818) has the molecular formula C198H377N16O5S3+ and a molecular weight of 3158.50 g/mol. Its IUPAC name is 1-tert-butyl-4-(2,2-dimethylpropyl)benzene;1-tert-butyl-4-(2,2-dimethylpropyl)cyclohexane;1-tert-butyl-4-(2,2-dimethylpropyl)-3,6-dihydro-2H-pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)piperazine;1-tert-butyl-4-(2,2-dimethylpropyl)piperidine;4-tert-butyl-1-(2,2-dimethylpropyl)piperidine;1-tert-butyl-4-(2,2-dimethylpropyl)pyrazole;2-tert-butyl-5-(2,2-dimethylpropyl)pyridine;5-tert-butyl-2-(2,2-dimethylpropyl)pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)pyridin-1-ium;2-tert-butyl-5-(2,2-dimethylpropyl)pyrimidine;4-(2,2-dimethylpropyl)morpholine;4-(2,2-dimethylpropyl)oxane;4-(2,2-dimethylpropyl)-1,4-thiazinane 1,1-dioxide;4-(2,2-dimethylpropyl)-1,4-thiazinane 1-oxide;4-(2,2-dimethylpropyl)thiomorpholine.

Molecular Properties

Compound Name1-tert-butyl-4-(2,2-dimethylpropyl)benzene;1-tert-butyl-4-(2,2-dimethylpropyl)cyclohexane;1-tert-butyl-4-(2,2-dimethylpropyl)-3,6-dihydro-2H-pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)piperazine;1-tert-butyl-4-(2,2-dimethylpropyl)piperidine;4-tert-butyl-1-(2,2-dimethylpropyl)piperidine;1-tert-butyl-4-(2,2-dimethylpropyl)pyrazole;2-tert-butyl-5-(2,2-dimethylpropyl)pyridine;5-tert-butyl-2-(2,2-dimethylpropyl)pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)pyridin-1-ium;2-tert-butyl-5-(2,2-dimethylpropyl)pyrimidine;4-(2,2-dimethylpropyl)morpholine;4-(2,2-dimethylpropyl)oxane;4-(2,2-dimethylpropyl)-1,4-thiazinane 1,1-dioxide;4-(2,2-dimethylpropyl)-1,4-thiazinane 1-oxide;4-(2,2-dimethylpropyl)thiomorpholine
PubChem CID159178818
Molecular FormulaC198H377N16O5S3+
Molecular Weight3158.50 g/mol
Exact Mass3155.89
IUPAC Name1-tert-butyl-4-(2,2-dimethylpropyl)benzene;1-tert-butyl-4-(2,2-dimethylpropyl)cyclohexane;1-tert-butyl-4-(2,2-dimethylpropyl)-3,6-dihydro-2H-pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)piperazine;1-tert-butyl-4-(2,2-dimethylpropyl)piperidine;4-tert-butyl-1-(2,2-dimethylpropyl)piperidine;1-tert-butyl-4-(2,2-dimethylpropyl)pyrazole;2-tert-butyl-5-(2,2-dimethylpropyl)pyridine;5-tert-butyl-2-(2,2-dimethylpropyl)pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)pyridin-1-ium;2-tert-butyl-5-(2,2-dimethylpropyl)pyrimidine;4-(2,2-dimethylpropyl)morpholine;4-(2,2-dimethylpropyl)oxane;4-(2,2-dimethylpropyl)-1,4-thiazinane 1,1-dioxide;4-(2,2-dimethylpropyl)-1,4-thiazinane 1-oxide;4-(2,2-dimethylpropyl)thiomorpholine
SMILESCC(C)(C)CC1=CCN(C(C)(C)C)CC1.CC(C)(C)CC1CCC(C(C)(C)C)CC1.CC(C)(C)CC1CCN(C(C)(C)C)CC1.CC(C)(C)CC1CCOCC1.CC(C)(C)CN1CCC(C(C)(C)C)CC1.CC(C)(C)CN1CCN(C(C)(C)C)CC1.CC(C)(C)CN1CCOCC1.CC(C)(C)CN1CCS(=O)(=O)CC1.CC(C)(C)CN1CCS(=O)CC1.CC(C)(C)CN1CCSCC1.CC(C)(C)Cc1cc[n+](C(C)(C)C)cc1.CC(C)(C)Cc1ccc(C(C)(C)C)cc1.CC(C)(C)Cc1ccc(C(C)(C)C)cn1.CC(C)(C)Cc1ccc(C(C)(C)C)nc1.CC(C)(C)Cc1cnc(C(C)(C)C)nc1.CC(C)(C)Cc1cnn(C(C)(C)C)c1
InChIInChI=1S/C15H30.C15H24.2C14H29N.C14H27N.C14H24N.2C14H23N.C13H22N2.C13H28N2.C12H22N2.C10H20O.C9H19NO2S.C9H19NOS.C9H19NO.C9H19NS/c2*1-14(2,3)11-12-7-9-13(10-8-12)15(4,5)6;1-13(2,3)11-15-9-7-12(8-10-15)14(4,5)6;3*1-13(2,3)11-12-7-9-15(10-8-12)14(4,5)6;1-13(2,3)9-12-8-7-11(10-15-12)14(4,5)6;1-13(2,3)9-11-7-8-12(15-10-11)14(4,5)6;1-12(2,3)7-10-8-14-11(15-9-10)13(4,5)6;1-12(2,3)11-14-7-9-15(10-8-14)13(4,5)6;1-11(2,3)7-10-8-13-14(9-10)12(4,5)6;1-10(2,3)8-9-4-6-11-7-5-9;1-9(2,3)8-10-4-6-13(11,12)7-5-10;1-9(2,3)8-10-4-6-12(11)7-5-10;2*1-9(2,3)8-10-4-6-11-7-5-10/h12-13H,7-11H2,1-6H3;7-10H,11H2,1-6H3;2*12H,7-11H2,1-6H3;7H,8-11H2,1-6H3;7-10H,11H2,1-6H3;2*7-8,10H,9H2,1-6H3;8-9H,7H2,1-6H3;7-11H2,1-6H3;8-9H,7H2,1-6H3;9H,4-8H2,1-3H3;4-8H2,1-3H3;4-8H2,1-3H3;2*4-8H2,1-3H3/q;;;;;+1;;;;;;;;;;
InChIKeyWCOYWQGSBFIRJN-UHFFFAOYSA-N
XLogP49.87
TPSA172.09 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds16
Heavy Atoms222
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003158.50
LogP ≤ 549.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze 1-tert-butyl-4-(2,2-dimethylpropyl)benzene;1-tert-butyl-4-(2,2-dimethylpropyl)cyclohexane;1-tert-butyl-4-(2,2-dimethylpropyl)-3,6-dihydro-2H-pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)piperazine;1-tert-butyl-4-(2,2-dimethylpropyl)piperidine;4-tert-butyl-1-(2,2-dimethylpropyl)piperidine;1-tert-butyl-4-(2,2-dimethylpropyl)pyrazole;2-tert-butyl-5-(2,2-dimethylpropyl)pyridine;5-tert-butyl-2-(2,2-dimethylpropyl)pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)pyridin-1-ium;2-tert-butyl-5-(2,2-dimethylpropyl)pyrimidine;4-(2,2-dimethylpropyl)morpholine;4-(2,2-dimethylpropyl)oxane;4-(2,2-dimethylpropyl)-1,4-thiazinane 1,1-dioxide;4-(2,2-dimethylpropyl)-1,4-thiazinane 1-oxide;4-(2,2-dimethylpropyl)thiomorpholine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-4-(2,2-dimethylpropyl)benzene;1-tert-butyl-4-(2,2-dimethylpropyl)cyclohexane;1-tert-butyl-4-(2,2-dimethylpropyl)-3,6-dihydro-2H-pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)piperazine;1-tert-butyl-4-(2,2-dimethylpropyl)piperidine;4-tert-butyl-1-(2,2-dimethylpropyl)piperidine;1-tert-butyl-4-(2,2-dimethylpropyl)pyrazole;2-tert-butyl-5-(2,2-dimethylpropyl)pyridine;5-tert-butyl-2-(2,2-dimethylpropyl)pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)pyridin-1-ium;2-tert-butyl-5-(2,2-dimethylpropyl)pyrimidine;4-(2,2-dimethylpropyl)morpholine;4-(2,2-dimethylpropyl)oxane;4-(2,2-dimethylpropyl)-1,4-thiazinane 1,1-dioxide;4-(2,2-dimethylpropyl)-1,4-thiazinane 1-oxide;4-(2,2-dimethylpropyl)thiomorpholine?
The IUPAC name of 1-tert-butyl-4-(2,2-dimethylpropyl)benzene;1-tert-butyl-4-(2,2-dimethylpropyl)cyclohexane;1-tert-butyl-4-(2,2-dimethylpropyl)-3,6-dihydro-2H-pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)piperazine;1-tert-butyl-4-(2,2-dimethylpropyl)piperidine;4-tert-butyl-1-(2,2-dimethylpropyl)piperidine;1-tert-butyl-4-(2,2-dimethylpropyl)pyrazole;2-tert-butyl-5-(2,2-dimethylpropyl)pyridine;5-tert-butyl-2-(2,2-dimethylpropyl)pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)pyridin-1-ium;2-tert-butyl-5-(2,2-dimethylpropyl)pyrimidine;4-(2,2-dimethylpropyl)morpholine;4-(2,2-dimethylpropyl)oxane;4-(2,2-dimethylpropyl)-1,4-thiazinane 1,1-dioxide;4-(2,2-dimethylpropyl)-1,4-thiazinane 1-oxide;4-(2,2-dimethylpropyl)thiomorpholine (CID 159178818) is 1-tert-butyl-4-(2,2-dimethylpropyl)benzene;1-tert-butyl-4-(2,2-dimethylpropyl)cyclohexane;1-tert-butyl-4-(2,2-dimethylpropyl)-3,6-dihydro-2H-pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)piperazine;1-tert-butyl-4-(2,2-dimethylpropyl)piperidine;4-tert-butyl-1-(2,2-dimethylpropyl)piperidine;1-tert-butyl-4-(2,2-dimethylpropyl)pyrazole;2-tert-butyl-5-(2,2-dimethylpropyl)pyridine;5-tert-butyl-2-(2,2-dimethylpropyl)pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)pyridin-1-ium;2-tert-butyl-5-(2,2-dimethylpropyl)pyrimidine;4-(2,2-dimethylpropyl)morpholine;4-(2,2-dimethylpropyl)oxane;4-(2,2-dimethylpropyl)-1,4-thiazinane 1,1-dioxide;4-(2,2-dimethylpropyl)-1,4-thiazinane 1-oxide;4-(2,2-dimethylpropyl)thiomorpholine.
What is the SMILES notation for 1-tert-butyl-4-(2,2-dimethylpropyl)benzene;1-tert-butyl-4-(2,2-dimethylpropyl)cyclohexane;1-tert-butyl-4-(2,2-dimethylpropyl)-3,6-dihydro-2H-pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)piperazine;1-tert-butyl-4-(2,2-dimethylpropyl)piperidine;4-tert-butyl-1-(2,2-dimethylpropyl)piperidine;1-tert-butyl-4-(2,2-dimethylpropyl)pyrazole;2-tert-butyl-5-(2,2-dimethylpropyl)pyridine;5-tert-butyl-2-(2,2-dimethylpropyl)pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)pyridin-1-ium;2-tert-butyl-5-(2,2-dimethylpropyl)pyrimidine;4-(2,2-dimethylpropyl)morpholine;4-(2,2-dimethylpropyl)oxane;4-(2,2-dimethylpropyl)-1,4-thiazinane 1,1-dioxide;4-(2,2-dimethylpropyl)-1,4-thiazinane 1-oxide;4-(2,2-dimethylpropyl)thiomorpholine?
The canonical SMILES for 1-tert-butyl-4-(2,2-dimethylpropyl)benzene;1-tert-butyl-4-(2,2-dimethylpropyl)cyclohexane;1-tert-butyl-4-(2,2-dimethylpropyl)-3,6-dihydro-2H-pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)piperazine;1-tert-butyl-4-(2,2-dimethylpropyl)piperidine;4-tert-butyl-1-(2,2-dimethylpropyl)piperidine;1-tert-butyl-4-(2,2-dimethylpropyl)pyrazole;2-tert-butyl-5-(2,2-dimethylpropyl)pyridine;5-tert-butyl-2-(2,2-dimethylpropyl)pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)pyridin-1-ium;2-tert-butyl-5-(2,2-dimethylpropyl)pyrimidine;4-(2,2-dimethylpropyl)morpholine;4-(2,2-dimethylpropyl)oxane;4-(2,2-dimethylpropyl)-1,4-thiazinane 1,1-dioxide;4-(2,2-dimethylpropyl)-1,4-thiazinane 1-oxide;4-(2,2-dimethylpropyl)thiomorpholine is CC(C)(C)CC1=CCN(C(C)(C)C)CC1.CC(C)(C)CC1CCC(C(C)(C)C)CC1.CC(C)(C)CC1CCN(C(C)(C)C)CC1.CC(C)(C)CC1CCOCC1.CC(C)(C)CN1CCC(C(C)(C)C)CC1.CC(C)(C)CN1CCN(C(C)(C)C)CC1.CC(C)(C)CN1CCOCC1.CC(C)(C)CN1CCS(=O)(=O)CC1.CC(C)(C)CN1CCS(=O)CC1.CC(C)(C)CN1CCSCC1.CC(C)(C)Cc1cc[n+](C(C)(C)C)cc1.CC(C)(C)Cc1ccc(C(C)(C)C)cc1.CC(C)(C)Cc1ccc(C(C)(C)C)cn1.CC(C)(C)Cc1ccc(C(C)(C)C)nc1.CC(C)(C)Cc1cnc(C(C)(C)C)nc1.CC(C)(C)Cc1cnn(C(C)(C)C)c1.
What is the InChIKey of 1-tert-butyl-4-(2,2-dimethylpropyl)benzene;1-tert-butyl-4-(2,2-dimethylpropyl)cyclohexane;1-tert-butyl-4-(2,2-dimethylpropyl)-3,6-dihydro-2H-pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)piperazine;1-tert-butyl-4-(2,2-dimethylpropyl)piperidine;4-tert-butyl-1-(2,2-dimethylpropyl)piperidine;1-tert-butyl-4-(2,2-dimethylpropyl)pyrazole;2-tert-butyl-5-(2,2-dimethylpropyl)pyridine;5-tert-butyl-2-(2,2-dimethylpropyl)pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)pyridin-1-ium;2-tert-butyl-5-(2,2-dimethylpropyl)pyrimidine;4-(2,2-dimethylpropyl)morpholine;4-(2,2-dimethylpropyl)oxane;4-(2,2-dimethylpropyl)-1,4-thiazinane 1,1-dioxide;4-(2,2-dimethylpropyl)-1,4-thiazinane 1-oxide;4-(2,2-dimethylpropyl)thiomorpholine?
The InChIKey is WCOYWQGSBFIRJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30.C15H24.2C14H29N.C14H27N.C14H24N.2C14H23N.C13H22N2.C13H28N2.C12H22N2.C10H20O.C9H19NO2S.C9H19NOS.C9H19NO.C9H19NS/c2*1-14(2,3)11-12-7-9-13(10-8-12)15(4,5)6;1-13(2,3)11-15-9-7-12(8-10-15)14(4,5)6;3*1-13(2,3)11-12-7-9-15(10-8-12)14(4,5)6;1-13(2,3)9-12-8-7-11(10-15-12)14(4,5)6;1-13(2,3)9-11-7-8-12(15-10-11)14(4,5)6;1-12(2,3)7-10-8-14-11(15-9-10)13(4,5)6;1-12(2,3)11-14-7-9-15(10-8-14)13(4,5)6;1-11(2,3)7-10-8-13-14(9-10)12(4,5)6;1-10(2,3)8-9-4-6-11-7-5-9;1-9(2,3)8-10-4-6-13(11,12)7-5-10;1-9(2,3)8-10-4-6-12(11)7-5-10;2*1-9(2,3)8-10-4-6-11-7-5-10/h12-13H,7-11H2,1-6H3;7-10H,11H2,1-6H3;2*12H,7-11H2,1-6H3;7H,8-11H2,1-6H3;7-10H,11H2,1-6H3;2*7-8,10H,9H2,1-6H3;8-9H,7H2,1-6H3;7-11H2,1-6H3;8-9H,7H2,1-6H3;9H,4-8H2,1-3H3;4-8H2,1-3H3;4-8H2,1-3H3;2*4-8H2,1-3H3/q;;;;;+1;;;;;;;;;;.
What are the key properties of 1-tert-butyl-4-(2,2-dimethylpropyl)benzene;1-tert-butyl-4-(2,2-dimethylpropyl)cyclohexane;1-tert-butyl-4-(2,2-dimethylpropyl)-3,6-dihydro-2H-pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)piperazine;1-tert-butyl-4-(2,2-dimethylpropyl)piperidine;4-tert-butyl-1-(2,2-dimethylpropyl)piperidine;1-tert-butyl-4-(2,2-dimethylpropyl)pyrazole;2-tert-butyl-5-(2,2-dimethylpropyl)pyridine;5-tert-butyl-2-(2,2-dimethylpropyl)pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)pyridin-1-ium;2-tert-butyl-5-(2,2-dimethylpropyl)pyrimidine;4-(2,2-dimethylpropyl)morpholine;4-(2,2-dimethylpropyl)oxane;4-(2,2-dimethylpropyl)-1,4-thiazinane 1,1-dioxide;4-(2,2-dimethylpropyl)-1,4-thiazinane 1-oxide;4-(2,2-dimethylpropyl)thiomorpholine?
1-tert-butyl-4-(2,2-dimethylpropyl)benzene;1-tert-butyl-4-(2,2-dimethylpropyl)cyclohexane;1-tert-butyl-4-(2,2-dimethylpropyl)-3,6-dihydro-2H-pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)piperazine;1-tert-butyl-4-(2,2-dimethylpropyl)piperidine;4-tert-butyl-1-(2,2-dimethylpropyl)piperidine;1-tert-butyl-4-(2,2-dimethylpropyl)pyrazole;2-tert-butyl-5-(2,2-dimethylpropyl)pyridine;5-tert-butyl-2-(2,2-dimethylpropyl)pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)pyridin-1-ium;2-tert-butyl-5-(2,2-dimethylpropyl)pyrimidine;4-(2,2-dimethylpropyl)morpholine;4-(2,2-dimethylpropyl)oxane;4-(2,2-dimethylpropyl)-1,4-thiazinane 1,1-dioxide;4-(2,2-dimethylpropyl)-1,4-thiazinane 1-oxide;4-(2,2-dimethylpropyl)thiomorpholine has a molecular weight of 3158.50 g/mol, XLogP of 49.87, 16 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-4-(2,2-dimethylpropyl)benzene;1-tert-butyl-4-(2,2-dimethylpropyl)cyclohexane;1-tert-butyl-4-(2,2-dimethylpropyl)-3,6-dihydro-2H-pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)piperazine;1-tert-butyl-4-(2,2-dimethylpropyl)piperidine;4-tert-butyl-1-(2,2-dimethylpropyl)piperidine;1-tert-butyl-4-(2,2-dimethylpropyl)pyrazole;2-tert-butyl-5-(2,2-dimethylpropyl)pyridine;5-tert-butyl-2-(2,2-dimethylpropyl)pyridine;1-tert-butyl-4-(2,2-dimethylpropyl)pyridin-1-ium;2-tert-butyl-5-(2,2-dimethylpropyl)pyrimidine;4-(2,2-dimethylpropyl)morpholine;4-(2,2-dimethylpropyl)oxane;4-(2,2-dimethylpropyl)-1,4-thiazinane 1,1-dioxide;4-(2,2-dimethylpropyl)-1,4-thiazinane 1-oxide;4-(2,2-dimethylpropyl)thiomorpholine is sourced from PubChem (CID 159178818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).