1-[2-(cyclohexylmethyl)cyclopentyl]-N-methylmethanamine

C14H27N — CID 81033803

IUPAC1-[2-(cyclohexylmethyl)cyclopentyl]-N-methylmethanamine
SMILESCNCC1CCCC1CC1CCCCC1
InChIInChI=1S/C14H27N/c1-15-11-14-9-5-8-13(14)10-12-6-3-2-4-7-12/h12-15H,2-11H2,1H3
InChIKeyGIDFJHUIRPYPBF-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.59
Rot. Bonds4

About 1-[2-(cyclohexylmethyl)cyclopentyl]-N-methylmethanamine

1-[2-(cyclohexylmethyl)cyclopentyl]-N-methylmethanamine (PubChem CID 81033803) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is 1-[2-(cyclohexylmethyl)cyclopentyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(cyclohexylmethyl)cyclopentyl]-N-methylmethanamine
PubChem CID81033803
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name1-[2-(cyclohexylmethyl)cyclopentyl]-N-methylmethanamine
SMILESCNCC1CCCC1CC1CCCCC1
InChIInChI=1S/C14H27N/c1-15-11-14-9-5-8-13(14)10-12-6-3-2-4-7-12/h12-15H,2-11H2,1H3
InChIKeyGIDFJHUIRPYPBF-UHFFFAOYSA-N
XLogP3.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
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 1-[2-(cyclohexylmethyl)cyclopentyl]-N-methylmethanamine?
The IUPAC name of 1-[2-(cyclohexylmethyl)cyclopentyl]-N-methylmethanamine (CID 81033803) is 1-[2-(cyclohexylmethyl)cyclopentyl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(cyclohexylmethyl)cyclopentyl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(cyclohexylmethyl)cyclopentyl]-N-methylmethanamine is CNCC1CCCC1CC1CCCCC1.
What is the InChIKey of 1-[2-(cyclohexylmethyl)cyclopentyl]-N-methylmethanamine?
The InChIKey is GIDFJHUIRPYPBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-15-11-14-9-5-8-13(14)10-12-6-3-2-4-7-12/h12-15H,2-11H2,1H3.
What are the key properties of 1-[2-(cyclohexylmethyl)cyclopentyl]-N-methylmethanamine?
1-[2-(cyclohexylmethyl)cyclopentyl]-N-methylmethanamine has a molecular weight of 209.38 g/mol, XLogP of 3.59, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(cyclohexylmethyl)cyclopentyl]-N-methylmethanamine is sourced from PubChem (CID 81033803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).