2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine

C14H27N — CID 107417002

IUPAC2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine
SMILESCC1CCCC1CNC1CCCCC1C
InChIInChI=1S/C14H27N/c1-11-7-5-8-13(11)10-15-14-9-4-3-6-12(14)2/h11-15H,3-10H2,1-2H3
InChIKeyHMLVAQRQWUNPAF-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.59
Rot. Bonds3

About 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine

2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine (PubChem CID 107417002) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine
PubChem CID107417002
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine
SMILESCC1CCCC1CNC1CCCCC1C
InChIInChI=1S/C14H27N/c1-11-7-5-8-13(11)10-15-14-9-4-3-6-12(14)2/h11-15H,3-10H2,1-2H3
InChIKeyHMLVAQRQWUNPAF-UHFFFAOYSA-N
XLogP3.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine?
The IUPAC name of 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine (CID 107417002) is 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine?
The canonical SMILES for 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine is CC1CCCC1CNC1CCCCC1C.
What is the InChIKey of 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine?
The InChIKey is HMLVAQRQWUNPAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-11-7-5-8-13(11)10-15-14-9-4-3-6-12(14)2/h11-15H,3-10H2,1-2H3.
What are the key properties of 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine?
2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine has a molecular weight of 209.38 g/mol, XLogP of 3.59, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(2-methylcyclopentyl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 107417002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).