3-(furan-2-yl)-1-(3-propylphenyl)propan-1-amine

C16H21NO — CID 105187906

IUPAC3-(furan-2-yl)-1-(3-propylphenyl)propan-1-amine
SMILESCCCc1cccc(C(N)CCc2ccco2)c1
InChIInChI=1S/C16H21NO/c1-2-5-13-6-3-7-14(12-13)16(17)10-9-15-8-4-11-18-15/h3-4,6-8,11-12,16H,2,5,9-10,17H2,1H3
InChIKeyKEEVXSLKRVZCIZ-UHFFFAOYSA-N
MW243.35 g/mol
LogP3.86
Rot. Bonds6

About 3-(furan-2-yl)-1-(3-propylphenyl)propan-1-amine

3-(furan-2-yl)-1-(3-propylphenyl)propan-1-amine (PubChem CID 105187906) has the molecular formula C16H21NO and a molecular weight of 243.35 g/mol. Its IUPAC name is 3-(furan-2-yl)-1-(3-propylphenyl)propan-1-amine.

Molecular Properties

Compound Name3-(furan-2-yl)-1-(3-propylphenyl)propan-1-amine
PubChem CID105187906
Molecular FormulaC16H21NO
Molecular Weight243.35 g/mol
Exact Mass243.16
IUPAC Name3-(furan-2-yl)-1-(3-propylphenyl)propan-1-amine
SMILESCCCc1cccc(C(N)CCc2ccco2)c1
InChIInChI=1S/C16H21NO/c1-2-5-13-6-3-7-14(12-13)16(17)10-9-15-8-4-11-18-15/h3-4,6-8,11-12,16H,2,5,9-10,17H2,1H3
InChIKeyKEEVXSLKRVZCIZ-UHFFFAOYSA-N
XLogP3.86
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(furan-2-yl)-1-(3-propylphenyl)propan-1-amine with MolForge

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

Launch Full Analysis

Related Compounds

1-(3-fluorophenyl)-3-(furan-2-yl)propan-1-amine
CID 105092774
(1S)-1-(3,4-dimethylphenyl)-3-(furan-2-yl)propan-1-amine
CID 40511217
1-(3-propylphenyl)-3-pyridin-4-ylpropan-1-amine
CID 105188013
1-(3-propylphenyl)ethanamine
CID 116543909
3-(furan-2-yl)-1-(4-propylphenyl)propan-1-ol
CID 105095239
1-(3-propylphenyl)-4-thiophen-2-ylbutan-1-amine
CID 105187931
3-(furan-2-yl)-1-(2-methylquinolin-6-yl)propan-1-amine
CID 105172248
N-[[3-(difluoromethyl)phenyl]methyl]-4-(furan-2-yl)butan-2-amine
CID 115526047
3-methyl-1-(3-propylphenyl)pentan-1-amine
CID 105050445
2-(2-methylpropylsulfanyl)-1-(3-propylphenyl)ethanamine
CID 116544446
1-(2,3-dimethylphenyl)-3-(furan-2-yl)propan-1-amine
CID 105140596
2-(3,4-dimethylphenyl)-1-(3-propylphenyl)ethanamine
CID 116544264

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-1-(3-propylphenyl)propan-1-amine?
The IUPAC name of 3-(furan-2-yl)-1-(3-propylphenyl)propan-1-amine (CID 105187906) is 3-(furan-2-yl)-1-(3-propylphenyl)propan-1-amine.
What is the SMILES notation for 3-(furan-2-yl)-1-(3-propylphenyl)propan-1-amine?
The canonical SMILES for 3-(furan-2-yl)-1-(3-propylphenyl)propan-1-amine is CCCc1cccc(C(N)CCc2ccco2)c1.
What is the InChIKey of 3-(furan-2-yl)-1-(3-propylphenyl)propan-1-amine?
The InChIKey is KEEVXSLKRVZCIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO/c1-2-5-13-6-3-7-14(12-13)16(17)10-9-15-8-4-11-18-15/h3-4,6-8,11-12,16H,2,5,9-10,17H2,1H3.
What are the key properties of 3-(furan-2-yl)-1-(3-propylphenyl)propan-1-amine?
3-(furan-2-yl)-1-(3-propylphenyl)propan-1-amine has a molecular weight of 243.35 g/mol, XLogP of 3.86, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-1-(3-propylphenyl)propan-1-amine is sourced from PubChem (CID 105187906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).