N-methyl-2-(2-methylpentyl)cyclohexan-1-amine

C13H27N — CID 62267127

IUPACN-methyl-2-(2-methylpentyl)cyclohexan-1-amine
SMILESCCCC(C)CC1CCCCC1NC
InChIInChI=1S/C13H27N/c1-4-7-11(2)10-12-8-5-6-9-13(12)14-3/h11-14H,4-10H2,1-3H3
InChIKeyMWIQMRDMQCJKNB-UHFFFAOYSA-N
MW197.37 g/mol
LogP3.59
Rot. Bonds5

About N-methyl-2-(2-methylpentyl)cyclohexan-1-amine

N-methyl-2-(2-methylpentyl)cyclohexan-1-amine (PubChem CID 62267127) has the molecular formula C13H27N and a molecular weight of 197.37 g/mol. Its IUPAC name is N-methyl-2-(2-methylpentyl)cyclohexan-1-amine.

Molecular Properties

Compound NameN-methyl-2-(2-methylpentyl)cyclohexan-1-amine
PubChem CID62267127
Molecular FormulaC13H27N
Molecular Weight197.37 g/mol
Exact Mass197.21
IUPAC NameN-methyl-2-(2-methylpentyl)cyclohexan-1-amine
SMILESCCCC(C)CC1CCCCC1NC
InChIInChI=1S/C13H27N/c1-4-7-11(2)10-12-8-5-6-9-13(12)14-3/h11-14H,4-10H2,1-3H3
InChIKeyMWIQMRDMQCJKNB-UHFFFAOYSA-N
XLogP3.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.37
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-2-(2-methylpentyl)cyclopropan-1-amine
CID 163758904
N-methyl-2-(2-methylpropyl)cyclohexan-1-amine
CID 61382234
4-tert-butyl-N-methyl-2-(2-methylpentyl)cyclohexan-1-amine
CID 63401489
[2-(2-methylpentyl)cyclohexyl]methanamine
CID 81009598
ethanol;N-methyl-2-(2-methylpropyl)cyclopentan-1-amine
CID 71071852
2-(2-ethylhexyl)-N-methylcyclopentan-1-amine
CID 63400350
N-methyl-2-(4-methylpentyl)cyclohexan-1-amine
CID 83159039
1-N-methyl-2-N-pentan-2-ylcyclohexane-1,2-diamine
CID 70316419
N-methyl-2-[2-[methyl(pentan-2-yl)amino]ethyl]cyclopentan-1-amine
CID 79570190
2-[2-[2-(1-cyclobutyl-3-methyl-2-propylhexyl)cyclopentyl]propyl]-N-methylcyclopentan-1-amine
CID 154940211
2-ethyl-N-methylcycloheptan-1-amine;propan-1-ol
CID 71071435
N-methyl-2-octylcyclohexan-1-amine
CID 63400173

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2-methylpentyl)cyclohexan-1-amine?
The IUPAC name of N-methyl-2-(2-methylpentyl)cyclohexan-1-amine (CID 62267127) is N-methyl-2-(2-methylpentyl)cyclohexan-1-amine.
What is the SMILES notation for N-methyl-2-(2-methylpentyl)cyclohexan-1-amine?
The canonical SMILES for N-methyl-2-(2-methylpentyl)cyclohexan-1-amine is CCCC(C)CC1CCCCC1NC.
What is the InChIKey of N-methyl-2-(2-methylpentyl)cyclohexan-1-amine?
The InChIKey is MWIQMRDMQCJKNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N/c1-4-7-11(2)10-12-8-5-6-9-13(12)14-3/h11-14H,4-10H2,1-3H3.
What are the key properties of N-methyl-2-(2-methylpentyl)cyclohexan-1-amine?
N-methyl-2-(2-methylpentyl)cyclohexan-1-amine has a molecular weight of 197.37 g/mol, XLogP of 3.59, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2-methylpentyl)cyclohexan-1-amine is sourced from PubChem (CID 62267127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).