3,5-dimethyl-1-(3-methylbutyl)-1,2,4-triazole;1-(3-methylbutyl)pyrazole;1-(3-methylbutyl)pyrrole;5-(3-methylbutyl)-3H-pyrrole;2-(3-methylbutyl)-1,3-thiazole;1-(5-methylhexyl)pyrrole;3-methyl-1-(3-methylbutyl)pyrazole;2-methyl-1-(3-methylbutyl)pyrrole;5-methyl-3-(3-methylbutylsulfanyl)-1H-1,2,4-triazole;2-methyl-1-(4-methylpentyl)imidazole;1-methyl-2-(2-methylpropyl)imidazole;1-methyl-4-(2-methylpropyl)imidazole;3-methyl-4-(2-methylpropyl)-1,2,5-oxadiazole;3-methyl-5-(2-methylpropyl)-1,2,4-oxadiazole;3-methyl-5-(2-methylpropyl)-2H-pyrrole;1-(4-methylpentyl)piperidine;1-(4-methylpentyl)pyrazole;1-(4-methylpentyl)pyrrole;3-(4-methylpentyl)-1H-pyrrole;3-(2-methylpropyl)pyridine

C179H312N32O2S2 — CID 158623469

IUPAC3,5-dimethyl-1-(3-methylbutyl)-1,2,4-triazole;1-(3-methylbutyl)pyrazole;1-(3-methylbutyl)pyrrole;5-(3-methylbutyl)-3H-pyrrole;2-(3-methylbutyl)-1,3-thiazole;1-(5-methylhexyl)pyrrole;3-methyl-1-(3-methylbutyl)pyrazole;2-methyl-1-(3-methylbutyl)pyrrole;5-methyl-3-(3-methylbutylsulfanyl)-1H-1,2,4-triazole;2-methyl-1-(4-methylpentyl)imidazole;1-methyl-2-(2-methylpropyl)imidazole;1-methyl-4-(2-methylpropyl)imidazole;3-methyl-4-(2-methylpropyl)-1,2,5-oxadiazole;3-methyl-5-(2-methylpropyl)-1,2,4-oxadiazole;3-methyl-5-(2-methylpropyl)-2H-pyrrole;1-(4-methylpentyl)piperidine;1-(4-methylpentyl)pyrazole;1-(4-methylpentyl)pyrrole;3-(4-methylpentyl)-1H-pyrrole;3-(2-methylpropyl)pyridine
SMILESCC(C)CCC1=CCC=N1.CC(C)CCCCn1cccc1.CC(C)CCCN1CCCCC1.CC(C)CCCc1cc[nH]c1.CC(C)CCCn1cccc1.CC(C)CCCn1cccn1.CC(C)CCc1nccs1.CC(C)CCn1cccc1.CC(C)CCn1cccn1.CC(C)Cc1cccnc1.CC(C)Cc1cn(C)cn1.CC(C)Cc1nccn1C.CC1=CC(CC(C)C)=NC1.Cc1cccn1CCC(C)C.Cc1ccn(CCC(C)C)n1.Cc1nc(C)n(CCC(C)C)n1.Cc1nc(SCCC(C)C)n[nH]1.Cc1nccn1CCCC(C)C.Cc1noc(CC(C)C)n1.Cc1nonc1CC(C)C
InChIInChI=1S/C11H19N.C11H23N.C10H18N2.3C10H17N.C9H17N3.2C9H16N2.3C9H15N.C9H13N.C8H15N3S.3C8H14N2.C8H13NS.2C7H12N2O/c1-11(2)7-3-4-8-12-9-5-6-10-12;1-11(2)7-6-10-12-8-4-3-5-9-12;1-9(2)5-4-7-12-8-6-11-10(12)3;1-9(2)6-8-11-7-4-5-10(11)3;1-10(2)6-5-9-11-7-3-4-8-11;1-9(2)4-3-5-10-6-7-11-8-10;1-7(2)5-6-12-9(4)10-8(3)11-12;1-8(2)4-6-11-7-5-9(3)10-11;1-9(2)5-3-7-11-8-4-6-10-11;1-7(2)4-9-5-8(3)6-10-9;1-8(2)5-6-9-4-3-7-10-9;1-9(2)5-8-10-6-3-4-7-10;1-8(2)6-9-4-3-5-10-7-9;1-6(2)4-5-12-8-9-7(3)10-11-8;1-7(2)4-8-5-10(3)6-9-8;1-7(2)6-8-9-4-5-10(8)3;1-8(2)4-7-10-6-3-5-9-10;1-7(2)3-4-8-9-5-6-10-8;1-5(2)4-7-8-6(3)9-10-7;1-5(2)4-7-6(3)8-10-9-7/h5-6,9-11H,3-4,7-8H2,1-2H3;11H,3-10H2,1-2H3;6,8-9H,4-5,7H2,1-3H3;4-5,7,9H,6,8H2,1-3H3;3-4,7-8,10H,5-6,9H2,1-2H3;6-9,11H,3-5H2,1-2H3;7H,5-6H2,1-4H3;5,7-8H,4,6H2,1-3H3;4,6,8-9H,3,5,7H2,1-2H3;5,7H,4,6H2,1-3H3;4,7-8H,3,5-6H2,1-2H3;3-4,6-7,9H,5,8H2,1-2H3;3-5,7-8H,6H2,1-2H3;6H,4-5H2,1-3H3,(H,9,10,11);5-7H,4H2,1-3H3;4-5,7H,6H2,1-3H3;3,5-6,8H,4,7H2,1-2H3;5-7H,3-4H2,1-2H3;2*5H,4H2,1-3H3
InChIKeyHYHDCGFDOKZDOF-UHFFFAOYSA-N
MW3008.82 g/mol
LogP47.44
Rot. Bonds62

About 3,5-dimethyl-1-(3-methylbutyl)-1,2,4-triazole;1-(3-methylbutyl)pyrazole;1-(3-methylbutyl)pyrrole;5-(3-methylbutyl)-3H-pyrrole;2-(3-methylbutyl)-1,3-thiazole;1-(5-methylhexyl)pyrrole;3-methyl-1-(3-methylbutyl)pyrazole;2-methyl-1-(3-methylbutyl)pyrrole;5-methyl-3-(3-methylbutylsulfanyl)-1H-1,2,4-triazole;2-methyl-1-(4-methylpentyl)imidazole;1-methyl-2-(2-methylpropyl)imidazole;1-methyl-4-(2-methylpropyl)imidazole;3-methyl-4-(2-methylpropyl)-1,2,5-oxadiazole;3-methyl-5-(2-methylpropyl)-1,2,4-oxadiazole;3-methyl-5-(2-methylpropyl)-2H-pyrrole;1-(4-methylpentyl)piperidine;1-(4-methylpentyl)pyrazole;1-(4-methylpentyl)pyrrole;3-(4-methylpentyl)-1H-pyrrole;3-(2-methylpropyl)pyridine

3,5-dimethyl-1-(3-methylbutyl)-1,2,4-triazole;1-(3-methylbutyl)pyrazole;1-(3-methylbutyl)pyrrole;5-(3-methylbutyl)-3H-pyrrole;2-(3-methylbutyl)-1,3-thiazole;1-(5-methylhexyl)pyrrole;3-methyl-1-(3-methylbutyl)pyrazole;2-methyl-1-(3-methylbutyl)pyrrole;5-methyl-3-(3-methylbutylsulfanyl)-1H-1,2,4-triazole;2-methyl-1-(4-methylpentyl)imidazole;1-methyl-2-(2-methylpropyl)imidazole;1-methyl-4-(2-methylpropyl)imidazole;3-methyl-4-(2-methylpropyl)-1,2,5-oxadiazole;3-methyl-5-(2-methylpropyl)-1,2,4-oxadiazole;3-methyl-5-(2-methylpropyl)-2H-pyrrole;1-(4-methylpentyl)piperidine;1-(4-methylpentyl)pyrazole;1-(4-methylpentyl)pyrrole;3-(4-methylpentyl)-1H-pyrrole;3-(2-methylpropyl)pyridine (PubChem CID 158623469) has the molecular formula C179H312N32O2S2 and a molecular weight of 3008.82 g/mol. Its IUPAC name is 3,5-dimethyl-1-(3-methylbutyl)-1,2,4-triazole;1-(3-methylbutyl)pyrazole;1-(3-methylbutyl)pyrrole;5-(3-methylbutyl)-3H-pyrrole;2-(3-methylbutyl)-1,3-thiazole;1-(5-methylhexyl)pyrrole;3-methyl-1-(3-methylbutyl)pyrazole;2-methyl-1-(3-methylbutyl)pyrrole;5-methyl-3-(3-methylbutylsulfanyl)-1H-1,2,4-triazole;2-methyl-1-(4-methylpentyl)imidazole;1-methyl-2-(2-methylpropyl)imidazole;1-methyl-4-(2-methylpropyl)imidazole;3-methyl-4-(2-methylpropyl)-1,2,5-oxadiazole;3-methyl-5-(2-methylpropyl)-1,2,4-oxadiazole;3-methyl-5-(2-methylpropyl)-2H-pyrrole;1-(4-methylpentyl)piperidine;1-(4-methylpentyl)pyrazole;1-(4-methylpentyl)pyrrole;3-(4-methylpentyl)-1H-pyrrole;3-(2-methylpropyl)pyridine.

Molecular Properties

Compound Name3,5-dimethyl-1-(3-methylbutyl)-1,2,4-triazole;1-(3-methylbutyl)pyrazole;1-(3-methylbutyl)pyrrole;5-(3-methylbutyl)-3H-pyrrole;2-(3-methylbutyl)-1,3-thiazole;1-(5-methylhexyl)pyrrole;3-methyl-1-(3-methylbutyl)pyrazole;2-methyl-1-(3-methylbutyl)pyrrole;5-methyl-3-(3-methylbutylsulfanyl)-1H-1,2,4-triazole;2-methyl-1-(4-methylpentyl)imidazole;1-methyl-2-(2-methylpropyl)imidazole;1-methyl-4-(2-methylpropyl)imidazole;3-methyl-4-(2-methylpropyl)-1,2,5-oxadiazole;3-methyl-5-(2-methylpropyl)-1,2,4-oxadiazole;3-methyl-5-(2-methylpropyl)-2H-pyrrole;1-(4-methylpentyl)piperidine;1-(4-methylpentyl)pyrazole;1-(4-methylpentyl)pyrrole;3-(4-methylpentyl)-1H-pyrrole;3-(2-methylpropyl)pyridine
PubChem CID158623469
Molecular FormulaC179H312N32O2S2
Molecular Weight3008.82 g/mol
Exact Mass3006.47
IUPAC Name3,5-dimethyl-1-(3-methylbutyl)-1,2,4-triazole;1-(3-methylbutyl)pyrazole;1-(3-methylbutyl)pyrrole;5-(3-methylbutyl)-3H-pyrrole;2-(3-methylbutyl)-1,3-thiazole;1-(5-methylhexyl)pyrrole;3-methyl-1-(3-methylbutyl)pyrazole;2-methyl-1-(3-methylbutyl)pyrrole;5-methyl-3-(3-methylbutylsulfanyl)-1H-1,2,4-triazole;2-methyl-1-(4-methylpentyl)imidazole;1-methyl-2-(2-methylpropyl)imidazole;1-methyl-4-(2-methylpropyl)imidazole;3-methyl-4-(2-methylpropyl)-1,2,5-oxadiazole;3-methyl-5-(2-methylpropyl)-1,2,4-oxadiazole;3-methyl-5-(2-methylpropyl)-2H-pyrrole;1-(4-methylpentyl)piperidine;1-(4-methylpentyl)pyrazole;1-(4-methylpentyl)pyrrole;3-(4-methylpentyl)-1H-pyrrole;3-(2-methylpropyl)pyridine
SMILESCC(C)CCC1=CCC=N1.CC(C)CCCCn1cccc1.CC(C)CCCN1CCCCC1.CC(C)CCCc1cc[nH]c1.CC(C)CCCn1cccc1.CC(C)CCCn1cccn1.CC(C)CCc1nccs1.CC(C)CCn1cccc1.CC(C)CCn1cccn1.CC(C)Cc1cccnc1.CC(C)Cc1cn(C)cn1.CC(C)Cc1nccn1C.CC1=CC(CC(C)C)=NC1.Cc1cccn1CCC(C)C.Cc1ccn(CCC(C)C)n1.Cc1nc(C)n(CCC(C)C)n1.Cc1nc(SCCC(C)C)n[nH]1.Cc1nccn1CCCC(C)C.Cc1noc(CC(C)C)n1.Cc1nonc1CC(C)C
InChIInChI=1S/C11H19N.C11H23N.C10H18N2.3C10H17N.C9H17N3.2C9H16N2.3C9H15N.C9H13N.C8H15N3S.3C8H14N2.C8H13NS.2C7H12N2O/c1-11(2)7-3-4-8-12-9-5-6-10-12;1-11(2)7-6-10-12-8-4-3-5-9-12;1-9(2)5-4-7-12-8-6-11-10(12)3;1-9(2)6-8-11-7-4-5-10(11)3;1-10(2)6-5-9-11-7-3-4-8-11;1-9(2)4-3-5-10-6-7-11-8-10;1-7(2)5-6-12-9(4)10-8(3)11-12;1-8(2)4-6-11-7-5-9(3)10-11;1-9(2)5-3-7-11-8-4-6-10-11;1-7(2)4-9-5-8(3)6-10-9;1-8(2)5-6-9-4-3-7-10-9;1-9(2)5-8-10-6-3-4-7-10;1-8(2)6-9-4-3-5-10-7-9;1-6(2)4-5-12-8-9-7(3)10-11-8;1-7(2)4-8-5-10(3)6-9-8;1-7(2)6-8-9-4-5-10(8)3;1-8(2)4-7-10-6-3-5-9-10;1-7(2)3-4-8-9-5-6-10-8;1-5(2)4-7-8-6(3)9-10-7;1-5(2)4-7-6(3)8-10-9-7/h5-6,9-11H,3-4,7-8H2,1-2H3;11H,3-10H2,1-2H3;6,8-9H,4-5,7H2,1-3H3;4-5,7,9H,6,8H2,1-3H3;3-4,7-8,10H,5-6,9H2,1-2H3;6-9,11H,3-5H2,1-2H3;7H,5-6H2,1-4H3;5,7-8H,4,6H2,1-3H3;4,6,8-9H,3,5,7H2,1-2H3;5,7H,4,6H2,1-3H3;4,7-8H,3,5-6H2,1-2H3;3-4,6-7,9H,5,8H2,1-2H3;3-5,7-8H,6H2,1-2H3;6H,4-5H2,1-3H3,(H,9,10,11);5-7H,4H2,1-3H3;4-5,7H,6H2,1-3H3;3,5-6,8H,4,7H2,1-2H3;5-7H,3-4H2,1-2H3;2*5H,4H2,1-3H3
InChIKeyHYHDCGFDOKZDOF-UHFFFAOYSA-N
XLogP47.44
TPSA346.29 Ų
H-Bond Donors2
H-Bond Acceptors34
Rotatable Bonds62
Heavy Atoms215
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003008.82
LogP ≤ 547.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1034

Computed Properties (RDKit)

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

Analyze 3,5-dimethyl-1-(3-methylbutyl)-1,2,4-triazole;1-(3-methylbutyl)pyrazole;1-(3-methylbutyl)pyrrole;5-(3-methylbutyl)-3H-pyrrole;2-(3-methylbutyl)-1,3-thiazole;1-(5-methylhexyl)pyrrole;3-methyl-1-(3-methylbutyl)pyrazole;2-methyl-1-(3-methylbutyl)pyrrole;5-methyl-3-(3-methylbutylsulfanyl)-1H-1,2,4-triazole;2-methyl-1-(4-methylpentyl)imidazole;1-methyl-2-(2-methylpropyl)imidazole;1-methyl-4-(2-methylpropyl)imidazole;3-methyl-4-(2-methylpropyl)-1,2,5-oxadiazole;3-methyl-5-(2-methylpropyl)-1,2,4-oxadiazole;3-methyl-5-(2-methylpropyl)-2H-pyrrole;1-(4-methylpentyl)piperidine;1-(4-methylpentyl)pyrazole;1-(4-methylpentyl)pyrrole;3-(4-methylpentyl)-1H-pyrrole;3-(2-methylpropyl)pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-1-(3-methylbutyl)-1,2,4-triazole;1-(3-methylbutyl)pyrazole;1-(3-methylbutyl)pyrrole;5-(3-methylbutyl)-3H-pyrrole;2-(3-methylbutyl)-1,3-thiazole;1-(5-methylhexyl)pyrrole;3-methyl-1-(3-methylbutyl)pyrazole;2-methyl-1-(3-methylbutyl)pyrrole;5-methyl-3-(3-methylbutylsulfanyl)-1H-1,2,4-triazole;2-methyl-1-(4-methylpentyl)imidazole;1-methyl-2-(2-methylpropyl)imidazole;1-methyl-4-(2-methylpropyl)imidazole;3-methyl-4-(2-methylpropyl)-1,2,5-oxadiazole;3-methyl-5-(2-methylpropyl)-1,2,4-oxadiazole;3-methyl-5-(2-methylpropyl)-2H-pyrrole;1-(4-methylpentyl)piperidine;1-(4-methylpentyl)pyrazole;1-(4-methylpentyl)pyrrole;3-(4-methylpentyl)-1H-pyrrole;3-(2-methylpropyl)pyridine?
The IUPAC name of 3,5-dimethyl-1-(3-methylbutyl)-1,2,4-triazole;1-(3-methylbutyl)pyrazole;1-(3-methylbutyl)pyrrole;5-(3-methylbutyl)-3H-pyrrole;2-(3-methylbutyl)-1,3-thiazole;1-(5-methylhexyl)pyrrole;3-methyl-1-(3-methylbutyl)pyrazole;2-methyl-1-(3-methylbutyl)pyrrole;5-methyl-3-(3-methylbutylsulfanyl)-1H-1,2,4-triazole;2-methyl-1-(4-methylpentyl)imidazole;1-methyl-2-(2-methylpropyl)imidazole;1-methyl-4-(2-methylpropyl)imidazole;3-methyl-4-(2-methylpropyl)-1,2,5-oxadiazole;3-methyl-5-(2-methylpropyl)-1,2,4-oxadiazole;3-methyl-5-(2-methylpropyl)-2H-pyrrole;1-(4-methylpentyl)piperidine;1-(4-methylpentyl)pyrazole;1-(4-methylpentyl)pyrrole;3-(4-methylpentyl)-1H-pyrrole;3-(2-methylpropyl)pyridine (CID 158623469) is 3,5-dimethyl-1-(3-methylbutyl)-1,2,4-triazole;1-(3-methylbutyl)pyrazole;1-(3-methylbutyl)pyrrole;5-(3-methylbutyl)-3H-pyrrole;2-(3-methylbutyl)-1,3-thiazole;1-(5-methylhexyl)pyrrole;3-methyl-1-(3-methylbutyl)pyrazole;2-methyl-1-(3-methylbutyl)pyrrole;5-methyl-3-(3-methylbutylsulfanyl)-1H-1,2,4-triazole;2-methyl-1-(4-methylpentyl)imidazole;1-methyl-2-(2-methylpropyl)imidazole;1-methyl-4-(2-methylpropyl)imidazole;3-methyl-4-(2-methylpropyl)-1,2,5-oxadiazole;3-methyl-5-(2-methylpropyl)-1,2,4-oxadiazole;3-methyl-5-(2-methylpropyl)-2H-pyrrole;1-(4-methylpentyl)piperidine;1-(4-methylpentyl)pyrazole;1-(4-methylpentyl)pyrrole;3-(4-methylpentyl)-1H-pyrrole;3-(2-methylpropyl)pyridine.
What is the SMILES notation for 3,5-dimethyl-1-(3-methylbutyl)-1,2,4-triazole;1-(3-methylbutyl)pyrazole;1-(3-methylbutyl)pyrrole;5-(3-methylbutyl)-3H-pyrrole;2-(3-methylbutyl)-1,3-thiazole;1-(5-methylhexyl)pyrrole;3-methyl-1-(3-methylbutyl)pyrazole;2-methyl-1-(3-methylbutyl)pyrrole;5-methyl-3-(3-methylbutylsulfanyl)-1H-1,2,4-triazole;2-methyl-1-(4-methylpentyl)imidazole;1-methyl-2-(2-methylpropyl)imidazole;1-methyl-4-(2-methylpropyl)imidazole;3-methyl-4-(2-methylpropyl)-1,2,5-oxadiazole;3-methyl-5-(2-methylpropyl)-1,2,4-oxadiazole;3-methyl-5-(2-methylpropyl)-2H-pyrrole;1-(4-methylpentyl)piperidine;1-(4-methylpentyl)pyrazole;1-(4-methylpentyl)pyrrole;3-(4-methylpentyl)-1H-pyrrole;3-(2-methylpropyl)pyridine?
The canonical SMILES for 3,5-dimethyl-1-(3-methylbutyl)-1,2,4-triazole;1-(3-methylbutyl)pyrazole;1-(3-methylbutyl)pyrrole;5-(3-methylbutyl)-3H-pyrrole;2-(3-methylbutyl)-1,3-thiazole;1-(5-methylhexyl)pyrrole;3-methyl-1-(3-methylbutyl)pyrazole;2-methyl-1-(3-methylbutyl)pyrrole;5-methyl-3-(3-methylbutylsulfanyl)-1H-1,2,4-triazole;2-methyl-1-(4-methylpentyl)imidazole;1-methyl-2-(2-methylpropyl)imidazole;1-methyl-4-(2-methylpropyl)imidazole;3-methyl-4-(2-methylpropyl)-1,2,5-oxadiazole;3-methyl-5-(2-methylpropyl)-1,2,4-oxadiazole;3-methyl-5-(2-methylpropyl)-2H-pyrrole;1-(4-methylpentyl)piperidine;1-(4-methylpentyl)pyrazole;1-(4-methylpentyl)pyrrole;3-(4-methylpentyl)-1H-pyrrole;3-(2-methylpropyl)pyridine is CC(C)CCC1=CCC=N1.CC(C)CCCCn1cccc1.CC(C)CCCN1CCCCC1.CC(C)CCCc1cc[nH]c1.CC(C)CCCn1cccc1.CC(C)CCCn1cccn1.CC(C)CCc1nccs1.CC(C)CCn1cccc1.CC(C)CCn1cccn1.CC(C)Cc1cccnc1.CC(C)Cc1cn(C)cn1.CC(C)Cc1nccn1C.CC1=CC(CC(C)C)=NC1.Cc1cccn1CCC(C)C.Cc1ccn(CCC(C)C)n1.Cc1nc(C)n(CCC(C)C)n1.Cc1nc(SCCC(C)C)n[nH]1.Cc1nccn1CCCC(C)C.Cc1noc(CC(C)C)n1.Cc1nonc1CC(C)C.
What is the InChIKey of 3,5-dimethyl-1-(3-methylbutyl)-1,2,4-triazole;1-(3-methylbutyl)pyrazole;1-(3-methylbutyl)pyrrole;5-(3-methylbutyl)-3H-pyrrole;2-(3-methylbutyl)-1,3-thiazole;1-(5-methylhexyl)pyrrole;3-methyl-1-(3-methylbutyl)pyrazole;2-methyl-1-(3-methylbutyl)pyrrole;5-methyl-3-(3-methylbutylsulfanyl)-1H-1,2,4-triazole;2-methyl-1-(4-methylpentyl)imidazole;1-methyl-2-(2-methylpropyl)imidazole;1-methyl-4-(2-methylpropyl)imidazole;3-methyl-4-(2-methylpropyl)-1,2,5-oxadiazole;3-methyl-5-(2-methylpropyl)-1,2,4-oxadiazole;3-methyl-5-(2-methylpropyl)-2H-pyrrole;1-(4-methylpentyl)piperidine;1-(4-methylpentyl)pyrazole;1-(4-methylpentyl)pyrrole;3-(4-methylpentyl)-1H-pyrrole;3-(2-methylpropyl)pyridine?
The InChIKey is HYHDCGFDOKZDOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N.C11H23N.C10H18N2.3C10H17N.C9H17N3.2C9H16N2.3C9H15N.C9H13N.C8H15N3S.3C8H14N2.C8H13NS.2C7H12N2O/c1-11(2)7-3-4-8-12-9-5-6-10-12;1-11(2)7-6-10-12-8-4-3-5-9-12;1-9(2)5-4-7-12-8-6-11-10(12)3;1-9(2)6-8-11-7-4-5-10(11)3;1-10(2)6-5-9-11-7-3-4-8-11;1-9(2)4-3-5-10-6-7-11-8-10;1-7(2)5-6-12-9(4)10-8(3)11-12;1-8(2)4-6-11-7-5-9(3)10-11;1-9(2)5-3-7-11-8-4-6-10-11;1-7(2)4-9-5-8(3)6-10-9;1-8(2)5-6-9-4-3-7-10-9;1-9(2)5-8-10-6-3-4-7-10;1-8(2)6-9-4-3-5-10-7-9;1-6(2)4-5-12-8-9-7(3)10-11-8;1-7(2)4-8-5-10(3)6-9-8;1-7(2)6-8-9-4-5-10(8)3;1-8(2)4-7-10-6-3-5-9-10;1-7(2)3-4-8-9-5-6-10-8;1-5(2)4-7-8-6(3)9-10-7;1-5(2)4-7-6(3)8-10-9-7/h5-6,9-11H,3-4,7-8H2,1-2H3;11H,3-10H2,1-2H3;6,8-9H,4-5,7H2,1-3H3;4-5,7,9H,6,8H2,1-3H3;3-4,7-8,10H,5-6,9H2,1-2H3;6-9,11H,3-5H2,1-2H3;7H,5-6H2,1-4H3;5,7-8H,4,6H2,1-3H3;4,6,8-9H,3,5,7H2,1-2H3;5,7H,4,6H2,1-3H3;4,7-8H,3,5-6H2,1-2H3;3-4,6-7,9H,5,8H2,1-2H3;3-5,7-8H,6H2,1-2H3;6H,4-5H2,1-3H3,(H,9,10,11);5-7H,4H2,1-3H3;4-5,7H,6H2,1-3H3;3,5-6,8H,4,7H2,1-2H3;5-7H,3-4H2,1-2H3;2*5H,4H2,1-3H3.
What are the key properties of 3,5-dimethyl-1-(3-methylbutyl)-1,2,4-triazole;1-(3-methylbutyl)pyrazole;1-(3-methylbutyl)pyrrole;5-(3-methylbutyl)-3H-pyrrole;2-(3-methylbutyl)-1,3-thiazole;1-(5-methylhexyl)pyrrole;3-methyl-1-(3-methylbutyl)pyrazole;2-methyl-1-(3-methylbutyl)pyrrole;5-methyl-3-(3-methylbutylsulfanyl)-1H-1,2,4-triazole;2-methyl-1-(4-methylpentyl)imidazole;1-methyl-2-(2-methylpropyl)imidazole;1-methyl-4-(2-methylpropyl)imidazole;3-methyl-4-(2-methylpropyl)-1,2,5-oxadiazole;3-methyl-5-(2-methylpropyl)-1,2,4-oxadiazole;3-methyl-5-(2-methylpropyl)-2H-pyrrole;1-(4-methylpentyl)piperidine;1-(4-methylpentyl)pyrazole;1-(4-methylpentyl)pyrrole;3-(4-methylpentyl)-1H-pyrrole;3-(2-methylpropyl)pyridine?
3,5-dimethyl-1-(3-methylbutyl)-1,2,4-triazole;1-(3-methylbutyl)pyrazole;1-(3-methylbutyl)pyrrole;5-(3-methylbutyl)-3H-pyrrole;2-(3-methylbutyl)-1,3-thiazole;1-(5-methylhexyl)pyrrole;3-methyl-1-(3-methylbutyl)pyrazole;2-methyl-1-(3-methylbutyl)pyrrole;5-methyl-3-(3-methylbutylsulfanyl)-1H-1,2,4-triazole;2-methyl-1-(4-methylpentyl)imidazole;1-methyl-2-(2-methylpropyl)imidazole;1-methyl-4-(2-methylpropyl)imidazole;3-methyl-4-(2-methylpropyl)-1,2,5-oxadiazole;3-methyl-5-(2-methylpropyl)-1,2,4-oxadiazole;3-methyl-5-(2-methylpropyl)-2H-pyrrole;1-(4-methylpentyl)piperidine;1-(4-methylpentyl)pyrazole;1-(4-methylpentyl)pyrrole;3-(4-methylpentyl)-1H-pyrrole;3-(2-methylpropyl)pyridine has a molecular weight of 3008.82 g/mol, XLogP of 47.44, 62 rotatable bonds, 2 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-1-(3-methylbutyl)-1,2,4-triazole;1-(3-methylbutyl)pyrazole;1-(3-methylbutyl)pyrrole;5-(3-methylbutyl)-3H-pyrrole;2-(3-methylbutyl)-1,3-thiazole;1-(5-methylhexyl)pyrrole;3-methyl-1-(3-methylbutyl)pyrazole;2-methyl-1-(3-methylbutyl)pyrrole;5-methyl-3-(3-methylbutylsulfanyl)-1H-1,2,4-triazole;2-methyl-1-(4-methylpentyl)imidazole;1-methyl-2-(2-methylpropyl)imidazole;1-methyl-4-(2-methylpropyl)imidazole;3-methyl-4-(2-methylpropyl)-1,2,5-oxadiazole;3-methyl-5-(2-methylpropyl)-1,2,4-oxadiazole;3-methyl-5-(2-methylpropyl)-2H-pyrrole;1-(4-methylpentyl)piperidine;1-(4-methylpentyl)pyrazole;1-(4-methylpentyl)pyrrole;3-(4-methylpentyl)-1H-pyrrole;3-(2-methylpropyl)pyridine is sourced from PubChem (CID 158623469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).