N-(furan-3-ylmethyl)cyclohexanamine

C11H17NO — CID 828980

IUPACN-(furan-3-ylmethyl)cyclohexanamine
SMILESc1cc(CNC2CCCCC2)co1
InChIInChI=1S/C11H17NO/c1-2-4-11(5-3-1)12-8-10-6-7-13-9-10/h6-7,9,11-12H,1-5,8H2
InChIKeyWOKDOHAOOOCYGS-UHFFFAOYSA-N
MW179.26 g/mol
LogP2.70
Rot. Bonds3

About N-(furan-3-ylmethyl)cyclohexanamine

N-(furan-3-ylmethyl)cyclohexanamine (PubChem CID 828980) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is N-(furan-3-ylmethyl)cyclohexanamine.

Molecular Properties

Compound NameN-(furan-3-ylmethyl)cyclohexanamine
PubChem CID828980
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC NameN-(furan-3-ylmethyl)cyclohexanamine
SMILESc1cc(CNC2CCCCC2)co1
InChIInChI=1S/C11H17NO/c1-2-4-11(5-3-1)12-8-10-6-7-13-9-10/h6-7,9,11-12H,1-5,8H2
InChIKeyWOKDOHAOOOCYGS-UHFFFAOYSA-N
XLogP2.70
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(furan-3-ylmethyl)cyclohexanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(furan-3-ylmethyl)cyclohexanamine?
The IUPAC name of N-(furan-3-ylmethyl)cyclohexanamine (CID 828980) is N-(furan-3-ylmethyl)cyclohexanamine.
What is the SMILES notation for N-(furan-3-ylmethyl)cyclohexanamine?
The canonical SMILES for N-(furan-3-ylmethyl)cyclohexanamine is c1cc(CNC2CCCCC2)co1.
What is the InChIKey of N-(furan-3-ylmethyl)cyclohexanamine?
The InChIKey is WOKDOHAOOOCYGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-2-4-11(5-3-1)12-8-10-6-7-13-9-10/h6-7,9,11-12H,1-5,8H2.
What are the key properties of N-(furan-3-ylmethyl)cyclohexanamine?
N-(furan-3-ylmethyl)cyclohexanamine has a molecular weight of 179.26 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-3-ylmethyl)cyclohexanamine is sourced from PubChem (CID 828980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).