N-[2-(furan-2-yl)ethyl]-1-phenylpropan-2-amine

C15H19NO — CID 54037812

IUPACN-[2-(furan-2-yl)ethyl]-1-phenylpropan-2-amine
SMILESCC(Cc1ccccc1)NCCc1ccco1
InChIInChI=1S/C15H19NO/c1-13(12-14-6-3-2-4-7-14)16-10-9-15-8-5-11-17-15/h2-8,11,13,16H,9-10,12H2,1H3
InChIKeyLKFFWWIBDAPNIT-UHFFFAOYSA-N
MW229.32 g/mol
LogP3.04
Rot. Bonds6

About N-[2-(furan-2-yl)ethyl]-1-phenylpropan-2-amine

N-[2-(furan-2-yl)ethyl]-1-phenylpropan-2-amine (PubChem CID 54037812) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is N-[2-(furan-2-yl)ethyl]-1-phenylpropan-2-amine.

Molecular Properties

Compound NameN-[2-(furan-2-yl)ethyl]-1-phenylpropan-2-amine
PubChem CID54037812
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC NameN-[2-(furan-2-yl)ethyl]-1-phenylpropan-2-amine
SMILESCC(Cc1ccccc1)NCCc1ccco1
InChIInChI=1S/C15H19NO/c1-13(12-14-6-3-2-4-7-14)16-10-9-15-8-5-11-17-15/h2-8,11,13,16H,9-10,12H2,1H3
InChIKeyLKFFWWIBDAPNIT-UHFFFAOYSA-N
XLogP3.04
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-(furan-2-yl)ethyl]-1-phenylpropan-2-amine 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-[2-(furan-2-yl)ethyl]-1-phenylpropan-2-amine?
The IUPAC name of N-[2-(furan-2-yl)ethyl]-1-phenylpropan-2-amine (CID 54037812) is N-[2-(furan-2-yl)ethyl]-1-phenylpropan-2-amine.
What is the SMILES notation for N-[2-(furan-2-yl)ethyl]-1-phenylpropan-2-amine?
The canonical SMILES for N-[2-(furan-2-yl)ethyl]-1-phenylpropan-2-amine is CC(Cc1ccccc1)NCCc1ccco1.
What is the InChIKey of N-[2-(furan-2-yl)ethyl]-1-phenylpropan-2-amine?
The InChIKey is LKFFWWIBDAPNIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c1-13(12-14-6-3-2-4-7-14)16-10-9-15-8-5-11-17-15/h2-8,11,13,16H,9-10,12H2,1H3.
What are the key properties of N-[2-(furan-2-yl)ethyl]-1-phenylpropan-2-amine?
N-[2-(furan-2-yl)ethyl]-1-phenylpropan-2-amine has a molecular weight of 229.32 g/mol, XLogP of 3.04, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)ethyl]-1-phenylpropan-2-amine is sourced from PubChem (CID 54037812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).