N-tert-butyl-4-methylcyclohexan-1-amine;bis(1-tert-butyl-4-methylpiperidine);bis(1-tert-butylpiperidine);bis(2,2-dimethylpropylcyclohexane);4-(2,2-dimethylpropyl)-1-methylpiperidine;bis(N-methylmethanamine)

C86H184N8 — CID 164947922

IUPACN-tert-butyl-4-methylcyclohexan-1-amine;bis(1-tert-butyl-4-methylpiperidine);bis(1-tert-butylpiperidine);bis(2,2-dimethylpropylcyclohexane);4-(2,2-dimethylpropyl)-1-methylpiperidine;bis(N-methylmethanamine)
SMILESCC(C)(C)CC1CCCCC1.CC(C)(C)CC1CCCCC1.CC(C)(C)N1CCCCC1.CC(C)(C)N1CCCCC1.CC1CCC(NC(C)(C)C)CC1.CC1CCN(C(C)(C)C)CC1.CC1CCN(C(C)(C)C)CC1.CN1CCC(CC(C)(C)C)CC1.CNC.CNC
InChIInChI=1S/2C11H23N.2C11H22.2C10H21N.2C9H19N.2C2H7N/c1-11(2,3)9-10-5-7-12(4)8-6-10;1-9-5-7-10(8-6-9)12-11(2,3)4;2*1-11(2,3)9-10-7-5-4-6-8-10;2*1-9-5-7-11(8-6-9)10(2,3)4;2*1-9(2,3)10-7-5-4-6-8-10;2*1-3-2/h10H,5-9H2,1-4H3;9-10,12H,5-8H2,1-4H3;2*10H,4-9H2,1-3H3;2*9H,5-8H2,1-4H3;2*4-8H2,1-3H3;2*3H,1-2H3
InChIKeyADCVFCWPIONCKW-UHFFFAOYSA-N
MW1330.47 g/mol
LogP22.97
Rot. Bonds4

About N-tert-butyl-4-methylcyclohexan-1-amine;bis(1-tert-butyl-4-methylpiperidine);bis(1-tert-butylpiperidine);bis(2,2-dimethylpropylcyclohexane);4-(2,2-dimethylpropyl)-1-methylpiperidine;bis(N-methylmethanamine)

N-tert-butyl-4-methylcyclohexan-1-amine;bis(1-tert-butyl-4-methylpiperidine);bis(1-tert-butylpiperidine);bis(2,2-dimethylpropylcyclohexane);4-(2,2-dimethylpropyl)-1-methylpiperidine;bis(N-methylmethanamine) (PubChem CID 164947922) has the molecular formula C86H184N8 and a molecular weight of 1330.47 g/mol. Its IUPAC name is N-tert-butyl-4-methylcyclohexan-1-amine;bis(1-tert-butyl-4-methylpiperidine);bis(1-tert-butylpiperidine);bis(2,2-dimethylpropylcyclohexane);4-(2,2-dimethylpropyl)-1-methylpiperidine;bis(N-methylmethanamine).

Molecular Properties

Compound NameN-tert-butyl-4-methylcyclohexan-1-amine;bis(1-tert-butyl-4-methylpiperidine);bis(1-tert-butylpiperidine);bis(2,2-dimethylpropylcyclohexane);4-(2,2-dimethylpropyl)-1-methylpiperidine;bis(N-methylmethanamine)
PubChem CID164947922
Molecular FormulaC86H184N8
Molecular Weight1330.47 g/mol
Exact Mass1329.46
IUPAC NameN-tert-butyl-4-methylcyclohexan-1-amine;bis(1-tert-butyl-4-methylpiperidine);bis(1-tert-butylpiperidine);bis(2,2-dimethylpropylcyclohexane);4-(2,2-dimethylpropyl)-1-methylpiperidine;bis(N-methylmethanamine)
SMILESCC(C)(C)CC1CCCCC1.CC(C)(C)CC1CCCCC1.CC(C)(C)N1CCCCC1.CC(C)(C)N1CCCCC1.CC1CCC(NC(C)(C)C)CC1.CC1CCN(C(C)(C)C)CC1.CC1CCN(C(C)(C)C)CC1.CN1CCC(CC(C)(C)C)CC1.CNC.CNC
InChIInChI=1S/2C11H23N.2C11H22.2C10H21N.2C9H19N.2C2H7N/c1-11(2,3)9-10-5-7-12(4)8-6-10;1-9-5-7-10(8-6-9)12-11(2,3)4;2*1-11(2,3)9-10-7-5-4-6-8-10;2*1-9-5-7-11(8-6-9)10(2,3)4;2*1-9(2,3)10-7-5-4-6-8-10;2*1-3-2/h10H,5-9H2,1-4H3;9-10,12H,5-8H2,1-4H3;2*10H,4-9H2,1-3H3;2*9H,5-8H2,1-4H3;2*4-8H2,1-3H3;2*3H,1-2H3
InChIKeyADCVFCWPIONCKW-UHFFFAOYSA-N
XLogP22.97
TPSA52.29 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms94
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001330.47
LogP ≤ 522.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Analyze N-tert-butyl-4-methylcyclohexan-1-amine;bis(1-tert-butyl-4-methylpiperidine);bis(1-tert-butylpiperidine);bis(2,2-dimethylpropylcyclohexane);4-(2,2-dimethylpropyl)-1-methylpiperidine;bis(N-methylmethanamine) with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-4-methylcyclohexan-1-amine;bis(1-tert-butyl-4-methylpiperidine);bis(1-tert-butylpiperidine);bis(2,2-dimethylpropylcyclohexane);4-(2,2-dimethylpropyl)-1-methylpiperidine;bis(N-methylmethanamine)?
The IUPAC name of N-tert-butyl-4-methylcyclohexan-1-amine;bis(1-tert-butyl-4-methylpiperidine);bis(1-tert-butylpiperidine);bis(2,2-dimethylpropylcyclohexane);4-(2,2-dimethylpropyl)-1-methylpiperidine;bis(N-methylmethanamine) (CID 164947922) is N-tert-butyl-4-methylcyclohexan-1-amine;bis(1-tert-butyl-4-methylpiperidine);bis(1-tert-butylpiperidine);bis(2,2-dimethylpropylcyclohexane);4-(2,2-dimethylpropyl)-1-methylpiperidine;bis(N-methylmethanamine).
What is the SMILES notation for N-tert-butyl-4-methylcyclohexan-1-amine;bis(1-tert-butyl-4-methylpiperidine);bis(1-tert-butylpiperidine);bis(2,2-dimethylpropylcyclohexane);4-(2,2-dimethylpropyl)-1-methylpiperidine;bis(N-methylmethanamine)?
The canonical SMILES for N-tert-butyl-4-methylcyclohexan-1-amine;bis(1-tert-butyl-4-methylpiperidine);bis(1-tert-butylpiperidine);bis(2,2-dimethylpropylcyclohexane);4-(2,2-dimethylpropyl)-1-methylpiperidine;bis(N-methylmethanamine) is CC(C)(C)CC1CCCCC1.CC(C)(C)CC1CCCCC1.CC(C)(C)N1CCCCC1.CC(C)(C)N1CCCCC1.CC1CCC(NC(C)(C)C)CC1.CC1CCN(C(C)(C)C)CC1.CC1CCN(C(C)(C)C)CC1.CN1CCC(CC(C)(C)C)CC1.CNC.CNC.
What is the InChIKey of N-tert-butyl-4-methylcyclohexan-1-amine;bis(1-tert-butyl-4-methylpiperidine);bis(1-tert-butylpiperidine);bis(2,2-dimethylpropylcyclohexane);4-(2,2-dimethylpropyl)-1-methylpiperidine;bis(N-methylmethanamine)?
The InChIKey is ADCVFCWPIONCKW-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H23N.2C11H22.2C10H21N.2C9H19N.2C2H7N/c1-11(2,3)9-10-5-7-12(4)8-6-10;1-9-5-7-10(8-6-9)12-11(2,3)4;2*1-11(2,3)9-10-7-5-4-6-8-10;2*1-9-5-7-11(8-6-9)10(2,3)4;2*1-9(2,3)10-7-5-4-6-8-10;2*1-3-2/h10H,5-9H2,1-4H3;9-10,12H,5-8H2,1-4H3;2*10H,4-9H2,1-3H3;2*9H,5-8H2,1-4H3;2*4-8H2,1-3H3;2*3H,1-2H3.
What are the key properties of N-tert-butyl-4-methylcyclohexan-1-amine;bis(1-tert-butyl-4-methylpiperidine);bis(1-tert-butylpiperidine);bis(2,2-dimethylpropylcyclohexane);4-(2,2-dimethylpropyl)-1-methylpiperidine;bis(N-methylmethanamine)?
N-tert-butyl-4-methylcyclohexan-1-amine;bis(1-tert-butyl-4-methylpiperidine);bis(1-tert-butylpiperidine);bis(2,2-dimethylpropylcyclohexane);4-(2,2-dimethylpropyl)-1-methylpiperidine;bis(N-methylmethanamine) has a molecular weight of 1330.47 g/mol, XLogP of 22.97, 4 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-4-methylcyclohexan-1-amine;bis(1-tert-butyl-4-methylpiperidine);bis(1-tert-butylpiperidine);bis(2,2-dimethylpropylcyclohexane);4-(2,2-dimethylpropyl)-1-methylpiperidine;bis(N-methylmethanamine) is sourced from PubChem (CID 164947922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).