(3-cyclohexylcyclopentyl)methanamine

C12H23N — CID 83636273

IUPAC(3-cyclohexylcyclopentyl)methanamine
SMILESNCC1CCC(C2CCCCC2)C1
InChIInChI=1S/C12H23N/c13-9-10-6-7-12(8-10)11-4-2-1-3-5-11/h10-12H,1-9,13H2
InChIKeyHNVQKVNKOVHXJX-UHFFFAOYSA-N
MW181.32 g/mol
LogP2.94
Rot. Bonds2

About (3-cyclohexylcyclopentyl)methanamine

(3-cyclohexylcyclopentyl)methanamine (PubChem CID 83636273) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is (3-cyclohexylcyclopentyl)methanamine.

Molecular Properties

Compound Name(3-cyclohexylcyclopentyl)methanamine
PubChem CID83636273
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name(3-cyclohexylcyclopentyl)methanamine
SMILESNCC1CCC(C2CCCCC2)C1
InChIInChI=1S/C12H23N/c13-9-10-6-7-12(8-10)11-4-2-1-3-5-11/h10-12H,1-9,13H2
InChIKeyHNVQKVNKOVHXJX-UHFFFAOYSA-N
XLogP2.94
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3-cyclohexylcyclopentyl)methanamine?
The IUPAC name of (3-cyclohexylcyclopentyl)methanamine (CID 83636273) is (3-cyclohexylcyclopentyl)methanamine.
What is the SMILES notation for (3-cyclohexylcyclopentyl)methanamine?
The canonical SMILES for (3-cyclohexylcyclopentyl)methanamine is NCC1CCC(C2CCCCC2)C1.
What is the InChIKey of (3-cyclohexylcyclopentyl)methanamine?
The InChIKey is HNVQKVNKOVHXJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N/c13-9-10-6-7-12(8-10)11-4-2-1-3-5-11/h10-12H,1-9,13H2.
What are the key properties of (3-cyclohexylcyclopentyl)methanamine?
(3-cyclohexylcyclopentyl)methanamine has a molecular weight of 181.32 g/mol, XLogP of 2.94, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclohexylcyclopentyl)methanamine is sourced from PubChem (CID 83636273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).