2-[2-(3,5-dimethylcyclohexyl)propan-2-yl]-5-methylcyclohexan-1-amine

C18H35N — CID 64765355

IUPAC2-[2-(3,5-dimethylcyclohexyl)propan-2-yl]-5-methylcyclohexan-1-amine
SMILESCC1CCC(C(C)(C)C2CC(C)CC(C)C2)C(N)C1
InChIInChI=1S/C18H35N/c1-12-6-7-16(17(19)11-12)18(4,5)15-9-13(2)8-14(3)10-15/h12-17H,6-11,19H2,1-5H3
InChIKeyCQAIMZIBEPBFLX-UHFFFAOYSA-N
MW265.48 g/mol
LogP4.85
Rot. Bonds2

About 2-[2-(3,5-dimethylcyclohexyl)propan-2-yl]-5-methylcyclohexan-1-amine

2-[2-(3,5-dimethylcyclohexyl)propan-2-yl]-5-methylcyclohexan-1-amine (PubChem CID 64765355) has the molecular formula C18H35N and a molecular weight of 265.48 g/mol. Its IUPAC name is 2-[2-(3,5-dimethylcyclohexyl)propan-2-yl]-5-methylcyclohexan-1-amine.

Molecular Properties

Compound Name2-[2-(3,5-dimethylcyclohexyl)propan-2-yl]-5-methylcyclohexan-1-amine
PubChem CID64765355
Molecular FormulaC18H35N
Molecular Weight265.48 g/mol
Exact Mass265.28
IUPAC Name2-[2-(3,5-dimethylcyclohexyl)propan-2-yl]-5-methylcyclohexan-1-amine
SMILESCC1CCC(C(C)(C)C2CC(C)CC(C)C2)C(N)C1
InChIInChI=1S/C18H35N/c1-12-6-7-16(17(19)11-12)18(4,5)15-9-13(2)8-14(3)10-15/h12-17H,6-11,19H2,1-5H3
InChIKeyCQAIMZIBEPBFLX-UHFFFAOYSA-N
XLogP4.85
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.48
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[2-(4-ethylcyclohexyl)propan-2-yl]-5-methylcyclohexan-1-amine
CID 64765549
2-[2-(2-ethylcyclohexyl)propan-2-yl]-5-methylcyclohexan-1-amine
CID 64765179
5-methyl-2-(2-methylundecan-2-yl)cyclohexan-1-amine
CID 64765358
2-[2-(4-chlorophenyl)propan-2-yl]-5-methylcyclohexan-1-amine
CID 64765559
1-methyl-3-[2-(3-methylcyclopentyl)propan-2-yl]cyclopentane
CID 58630980
2-(1-cyclopentyl-2-methylpropan-2-yl)-5-methylcyclohexan-1-amine
CID 64765709
2-(5-ethoxy-2-methylpentan-2-yl)-5-methylcyclohexan-1-amine
CID 65177960
2-(2-bromo-4-methylcyclohexyl)propan-2-ylcycloheptane
CID 82924227
cis-(1R,2S)-4-methylcyclohexane-1,2-diamine
CID 101451140
2-(2,4-dimethylhexan-2-yl)-5-methylcyclohexan-1-amine
CID 64765342
(2R)-2-amino-4-methylcyclohexan-1-ol
CID 142197995
2-[2-(3-chloro-4-methylphenyl)propan-2-yl]-5-methylcyclohexan-1-amine
CID 107560993

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3,5-dimethylcyclohexyl)propan-2-yl]-5-methylcyclohexan-1-amine?
The IUPAC name of 2-[2-(3,5-dimethylcyclohexyl)propan-2-yl]-5-methylcyclohexan-1-amine (CID 64765355) is 2-[2-(3,5-dimethylcyclohexyl)propan-2-yl]-5-methylcyclohexan-1-amine.
What is the SMILES notation for 2-[2-(3,5-dimethylcyclohexyl)propan-2-yl]-5-methylcyclohexan-1-amine?
The canonical SMILES for 2-[2-(3,5-dimethylcyclohexyl)propan-2-yl]-5-methylcyclohexan-1-amine is CC1CCC(C(C)(C)C2CC(C)CC(C)C2)C(N)C1.
What is the InChIKey of 2-[2-(3,5-dimethylcyclohexyl)propan-2-yl]-5-methylcyclohexan-1-amine?
The InChIKey is CQAIMZIBEPBFLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N/c1-12-6-7-16(17(19)11-12)18(4,5)15-9-13(2)8-14(3)10-15/h12-17H,6-11,19H2,1-5H3.
What are the key properties of 2-[2-(3,5-dimethylcyclohexyl)propan-2-yl]-5-methylcyclohexan-1-amine?
2-[2-(3,5-dimethylcyclohexyl)propan-2-yl]-5-methylcyclohexan-1-amine has a molecular weight of 265.48 g/mol, XLogP of 4.85, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3,5-dimethylcyclohexyl)propan-2-yl]-5-methylcyclohexan-1-amine is sourced from PubChem (CID 64765355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).