2-(2,4-dimethylheptan-2-yl)-N,5-dimethylcyclohexan-1-amine

C17H35N — CID 64765922

IUPAC2-(2,4-dimethylheptan-2-yl)-N,5-dimethylcyclohexan-1-amine
SMILESCCCC(C)CC(C)(C)C1CCC(C)CC1NC
InChIInChI=1S/C17H35N/c1-7-8-14(3)12-17(4,5)15-10-9-13(2)11-16(15)18-6/h13-16,18H,7-12H2,1-6H3
InChIKeyGCUYSZDWZJIOGQ-UHFFFAOYSA-N
MW253.47 g/mol
LogP4.86
Rot. Bonds6

About 2-(2,4-dimethylheptan-2-yl)-N,5-dimethylcyclohexan-1-amine

2-(2,4-dimethylheptan-2-yl)-N,5-dimethylcyclohexan-1-amine (PubChem CID 64765922) has the molecular formula C17H35N and a molecular weight of 253.47 g/mol. Its IUPAC name is 2-(2,4-dimethylheptan-2-yl)-N,5-dimethylcyclohexan-1-amine.

Molecular Properties

Compound Name2-(2,4-dimethylheptan-2-yl)-N,5-dimethylcyclohexan-1-amine
PubChem CID64765922
Molecular FormulaC17H35N
Molecular Weight253.47 g/mol
Exact Mass253.28
IUPAC Name2-(2,4-dimethylheptan-2-yl)-N,5-dimethylcyclohexan-1-amine
SMILESCCCC(C)CC(C)(C)C1CCC(C)CC1NC
InChIInChI=1S/C17H35N/c1-7-8-14(3)12-17(4,5)15-10-9-13(2)11-16(15)18-6/h13-16,18H,7-12H2,1-6H3
InChIKeyGCUYSZDWZJIOGQ-UHFFFAOYSA-N
XLogP4.86
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.47
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N,5-dimethyl-2-(2-methyldecan-2-yl)cyclohexan-1-amine
CID 64764075
2-(2,4-dimethylhexan-2-yl)-5-methylcyclohexan-1-amine
CID 64765342
2-[1-(4-ethylphenyl)-2-methylpropan-2-yl]-N,5-dimethylcyclohexan-1-amine
CID 64764067
2-(2,5-dimethylhexan-2-yl)-5-methyl-N-propylcyclohexan-1-amine
CID 64766423
N,5-dimethyl-2-(2-methylhept-6-en-2-yl)cyclohexan-1-amine
CID 64764257
N,5-dimethyl-2-[2-methyl-1-(5-methyloxolan-2-yl)propan-2-yl]cyclohexan-1-amine
CID 103131899
2-[1-(3,4-dichlorophenyl)-2-methylpropan-2-yl]-N,5-dimethylcyclohexan-1-amine
CID 64765920
N,5-dimethyl-2-[2-methyl-1-(1,3-thiazol-2-yl)propan-2-yl]cyclohexan-1-amine
CID 79825191
4-tert-butyl-N-methyl-2-(2-methylpentyl)cyclohexan-1-amine
CID 63401489
N-methyl-2-(2-methylpentyl)cyclopropan-1-amine
CID 163758904
N,2,3,3,5-pentamethyloctan-2-amine
CID 126735741
N,2-dimethyl-3-pentan-2-ylcyclopentan-1-amine
CID 107888213

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylheptan-2-yl)-N,5-dimethylcyclohexan-1-amine?
The IUPAC name of 2-(2,4-dimethylheptan-2-yl)-N,5-dimethylcyclohexan-1-amine (CID 64765922) is 2-(2,4-dimethylheptan-2-yl)-N,5-dimethylcyclohexan-1-amine.
What is the SMILES notation for 2-(2,4-dimethylheptan-2-yl)-N,5-dimethylcyclohexan-1-amine?
The canonical SMILES for 2-(2,4-dimethylheptan-2-yl)-N,5-dimethylcyclohexan-1-amine is CCCC(C)CC(C)(C)C1CCC(C)CC1NC.
What is the InChIKey of 2-(2,4-dimethylheptan-2-yl)-N,5-dimethylcyclohexan-1-amine?
The InChIKey is GCUYSZDWZJIOGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35N/c1-7-8-14(3)12-17(4,5)15-10-9-13(2)11-16(15)18-6/h13-16,18H,7-12H2,1-6H3.
What are the key properties of 2-(2,4-dimethylheptan-2-yl)-N,5-dimethylcyclohexan-1-amine?
2-(2,4-dimethylheptan-2-yl)-N,5-dimethylcyclohexan-1-amine has a molecular weight of 253.47 g/mol, XLogP of 4.86, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylheptan-2-yl)-N,5-dimethylcyclohexan-1-amine is sourced from PubChem (CID 64765922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).