N-(furan-2-ylmethyl)-N-[(3R)-3-(4-methoxyphenyl)-4-phenylbutyl]acetamide

C24H27NO3 — CID 1427005

IUPACN-(furan-2-ylmethyl)-N-[(3R)-3-(4-methoxyphenyl)-4-phenylbutyl]acetamide
SMILESCOc1ccc([C@@H](CCN(Cc2ccco2)C(C)=O)Cc2ccccc2)cc1
InChIInChI=1S/C24H27NO3/c1-19(26)25(18-24-9-6-16-28-24)15-14-22(17-20-7-4-3-5-8-20)21-10-12-23(27-2)13-11-21/h3-13,16,22H,14-15,17-18H2,1-2H3/t22-/m0/s1
InChIKeyQCYHDYVUBLFVGM-QFIPXVFZSA-N
MW377.48 g/mol
LogP5.05
Rot. Bonds9

About N-(furan-2-ylmethyl)-N-[(3R)-3-(4-methoxyphenyl)-4-phenylbutyl]acetamide

N-(furan-2-ylmethyl)-N-[(3R)-3-(4-methoxyphenyl)-4-phenylbutyl]acetamide (PubChem CID 1427005) has the molecular formula C24H27NO3 and a molecular weight of 377.48 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N-[(3R)-3-(4-methoxyphenyl)-4-phenylbutyl]acetamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-N-[(3R)-3-(4-methoxyphenyl)-4-phenylbutyl]acetamide
PubChem CID1427005
Molecular FormulaC24H27NO3
Molecular Weight377.48 g/mol
Exact Mass377.20
IUPAC NameN-(furan-2-ylmethyl)-N-[(3R)-3-(4-methoxyphenyl)-4-phenylbutyl]acetamide
SMILESCOc1ccc([C@@H](CCN(Cc2ccco2)C(C)=O)Cc2ccccc2)cc1
InChIInChI=1S/C24H27NO3/c1-19(26)25(18-24-9-6-16-28-24)15-14-22(17-20-7-4-3-5-8-20)21-10-12-23(27-2)13-11-21/h3-13,16,22H,14-15,17-18H2,1-2H3/t22-/m0/s1
InChIKeyQCYHDYVUBLFVGM-QFIPXVFZSA-N
XLogP5.05
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.48
LogP ≤ 55.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-(furan-2-ylmethyl)-N-[(3R)-3-(4-methoxyphenyl)-4-phenylbutyl]acetamide 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

N-benzyl-N-[3-(4-methoxyphenyl)-4-phenylbutyl]acetamide
CID 2956858
N,N-bis(furan-2-ylmethyl)-2-(4-methoxyphenyl)acetamide
CID 52548109
N-(furan-2-ylmethyl)-N-[[4-(4-methoxyphenyl)phenyl]methyl]benzamide
CID 59260608
N-(furan-2-ylmethyl)-N-[3-phenyl-3-(4-propan-2-yloxyphenyl)propyl]propanamide
CID 3841014
N-[(4-methoxyphenyl)methyl]-N-[3-phenyl-3-(4-propan-2-yloxyphenyl)propyl]acetamide
CID 3708634
3-[acetyl(furan-2-ylmethyl)amino]-N-benzyl-N-phenylpropanamide
CID 113118141
N-(1,3-benzodioxol-5-ylmethyl)-N-[3-(1,3-benzodioxol-5-yl)-4-phenylbutyl]acetamide
CID 3149170
N-(furan-2-ylmethyl)-1-(4-methoxyphenyl)-N-methylethanamine
CID 50969326
N-benzyl-N-(furan-2-ylmethyl)-4-methoxybenzenesulfonamide
CID 1058767
(2S)-N-(furan-2-ylmethyl)-2-(4-methoxyphenoxy)-N-phenylpropanamide
CID 51930010
2-[5-(4-methylphenyl)-6-phenylhexyl]furan
CID 156599733
N-(furan-2-ylmethyl)-N-[2-[(4S)-4-(4-methoxyphenyl)-2,2-dimethyloxan-4-yl]ethyl]acetamide
CID 39377991

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N-[(3R)-3-(4-methoxyphenyl)-4-phenylbutyl]acetamide?
The IUPAC name of N-(furan-2-ylmethyl)-N-[(3R)-3-(4-methoxyphenyl)-4-phenylbutyl]acetamide (CID 1427005) is N-(furan-2-ylmethyl)-N-[(3R)-3-(4-methoxyphenyl)-4-phenylbutyl]acetamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-N-[(3R)-3-(4-methoxyphenyl)-4-phenylbutyl]acetamide?
The canonical SMILES for N-(furan-2-ylmethyl)-N-[(3R)-3-(4-methoxyphenyl)-4-phenylbutyl]acetamide is COc1ccc([C@@H](CCN(Cc2ccco2)C(C)=O)Cc2ccccc2)cc1.
What is the InChIKey of N-(furan-2-ylmethyl)-N-[(3R)-3-(4-methoxyphenyl)-4-phenylbutyl]acetamide?
The InChIKey is QCYHDYVUBLFVGM-QFIPXVFZSA-N. The full InChI is InChI=1S/C24H27NO3/c1-19(26)25(18-24-9-6-16-28-24)15-14-22(17-20-7-4-3-5-8-20)21-10-12-23(27-2)13-11-21/h3-13,16,22H,14-15,17-18H2,1-2H3/t22-/m0/s1.
What are the key properties of N-(furan-2-ylmethyl)-N-[(3R)-3-(4-methoxyphenyl)-4-phenylbutyl]acetamide?
N-(furan-2-ylmethyl)-N-[(3R)-3-(4-methoxyphenyl)-4-phenylbutyl]acetamide has a molecular weight of 377.48 g/mol, XLogP of 5.05, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-N-[(3R)-3-(4-methoxyphenyl)-4-phenylbutyl]acetamide is sourced from PubChem (CID 1427005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).