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

C20H21NO2 — CID 83973239

IUPAC3-(furan-2-yl)-2-(3-phenylmethoxyphenyl)propan-1-amine
SMILESNCC(Cc1ccco1)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C20H21NO2/c21-14-18(13-19-10-5-11-22-19)17-8-4-9-20(12-17)23-15-16-6-2-1-3-7-16/h1-12,18H,13-15,21H2
InChIKeyRSZDBEMXKVSUFK-UHFFFAOYSA-N
MW307.39 g/mol
LogP4.14
Rot. Bonds7

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

3-(furan-2-yl)-2-(3-phenylmethoxyphenyl)propan-1-amine (PubChem CID 83973239) has the molecular formula C20H21NO2 and a molecular weight of 307.39 g/mol. Its IUPAC name is 3-(furan-2-yl)-2-(3-phenylmethoxyphenyl)propan-1-amine.

Molecular Properties

Compound Name3-(furan-2-yl)-2-(3-phenylmethoxyphenyl)propan-1-amine
PubChem CID83973239
Molecular FormulaC20H21NO2
Molecular Weight307.39 g/mol
Exact Mass307.16
IUPAC Name3-(furan-2-yl)-2-(3-phenylmethoxyphenyl)propan-1-amine
SMILESNCC(Cc1ccco1)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C20H21NO2/c21-14-18(13-19-10-5-11-22-19)17-8-4-9-20(12-17)23-15-16-6-2-1-3-7-16/h1-12,18H,13-15,21H2
InChIKeyRSZDBEMXKVSUFK-UHFFFAOYSA-N
XLogP4.14
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(furan-2-yl)-2-(3-phenylmethoxyphenyl)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

3-phenyl-2-(3-phenylmethoxyphenyl)propan-1-amine
CID 83973248
N-(furan-2-ylmethyl)-1-(3-phenylmethoxyphenyl)methanamine;hydrochloride
CID 2996544
(1R)-1-(3-phenylmethoxyphenyl)propane-1,3-diamine
CID 171211251
(S)-(3-phenylmethoxyphenyl)-thiophen-3-ylmethanamine
CID 171211288
3-(3-ethoxyphenyl)-2-(3-phenoxyphenyl)propan-1-amine
CID 112538857
1-hexan-3-yl-3-phenylmethoxybenzene
CID 91388461
(S)-(3-phenylmethoxyphenyl)-thiophen-3-ylmethanamine;hydrochloride
CID 171211289
(2R)-2-amino-2-(3-phenylmethoxyphenyl)ethanol
CID 66515455
(1S)-1-(3-phenylmethoxyphenyl)butane-1,4-diamine;hydrochloride
CID 171230857
(1R)-1-(3-phenylmethoxyphenyl)pentane-1,5-diamine
CID 171211255
3-[2-(aminomethyl)-3-(furan-2-yl)propoxy]phenol
CID 117246266
(1S,2R)-1-amino-1-(3-phenylmethoxyphenyl)propan-2-ol
CID 171270166

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-2-(3-phenylmethoxyphenyl)propan-1-amine?
The IUPAC name of 3-(furan-2-yl)-2-(3-phenylmethoxyphenyl)propan-1-amine (CID 83973239) is 3-(furan-2-yl)-2-(3-phenylmethoxyphenyl)propan-1-amine.
What is the SMILES notation for 3-(furan-2-yl)-2-(3-phenylmethoxyphenyl)propan-1-amine?
The canonical SMILES for 3-(furan-2-yl)-2-(3-phenylmethoxyphenyl)propan-1-amine is NCC(Cc1ccco1)c1cccc(OCc2ccccc2)c1.
What is the InChIKey of 3-(furan-2-yl)-2-(3-phenylmethoxyphenyl)propan-1-amine?
The InChIKey is RSZDBEMXKVSUFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO2/c21-14-18(13-19-10-5-11-22-19)17-8-4-9-20(12-17)23-15-16-6-2-1-3-7-16/h1-12,18H,13-15,21H2.
What are the key properties of 3-(furan-2-yl)-2-(3-phenylmethoxyphenyl)propan-1-amine?
3-(furan-2-yl)-2-(3-phenylmethoxyphenyl)propan-1-amine has a molecular weight of 307.39 g/mol, XLogP of 4.14, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-2-(3-phenylmethoxyphenyl)propan-1-amine is sourced from PubChem (CID 83973239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).