N-benzyl-N-[3-(furan-2-yl)-3-(4-methylphenyl)propyl]propanamide

C24H27NO2 — CID 2938663

IUPACN-benzyl-N-[3-(furan-2-yl)-3-(4-methylphenyl)propyl]propanamide
SMILESCCC(=O)N(CCC(c1ccc(C)cc1)c1ccco1)Cc1ccccc1
InChIInChI=1S/C24H27NO2/c1-3-24(26)25(18-20-8-5-4-6-9-20)16-15-22(23-10-7-17-27-23)21-13-11-19(2)12-14-21/h4-14,17,22H,3,15-16,18H2,1-2H3
InChIKeyFWBGYWKXBRTCKT-UHFFFAOYSA-N
MW361.49 g/mol
LogP5.55
Rot. Bonds8

About N-benzyl-N-[3-(furan-2-yl)-3-(4-methylphenyl)propyl]propanamide

N-benzyl-N-[3-(furan-2-yl)-3-(4-methylphenyl)propyl]propanamide (PubChem CID 2938663) has the molecular formula C24H27NO2 and a molecular weight of 361.49 g/mol. Its IUPAC name is N-benzyl-N-[3-(furan-2-yl)-3-(4-methylphenyl)propyl]propanamide.

Molecular Properties

Compound NameN-benzyl-N-[3-(furan-2-yl)-3-(4-methylphenyl)propyl]propanamide
PubChem CID2938663
Molecular FormulaC24H27NO2
Molecular Weight361.49 g/mol
Exact Mass361.20
IUPAC NameN-benzyl-N-[3-(furan-2-yl)-3-(4-methylphenyl)propyl]propanamide
SMILESCCC(=O)N(CCC(c1ccc(C)cc1)c1ccco1)Cc1ccccc1
InChIInChI=1S/C24H27NO2/c1-3-24(26)25(18-20-8-5-4-6-9-20)16-15-22(23-10-7-17-27-23)21-13-11-19(2)12-14-21/h4-14,17,22H,3,15-16,18H2,1-2H3
InChIKeyFWBGYWKXBRTCKT-UHFFFAOYSA-N
XLogP5.55
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.49
LogP ≤ 55.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[4-(dimethylamino)phenyl]methyl]-N-[(3R)-3-(furan-2-yl)-3-phenylpropyl]propanamide
CID 1426584
N-[(3S)-3-(4-fluorophenyl)-3-(furan-2-yl)propyl]-N-[(2-fluorophenyl)methyl]propanamide
CID 1384951
N-[3-(4-fluorophenyl)-3-(furan-2-yl)propyl]-N-(thiophen-2-ylmethyl)propanamide
CID 4553376
N-[[4-(dimethylamino)phenyl]methyl]-N-[(3S)-3-(furan-2-yl)-3-(2-methoxyphenyl)propyl]propanamide
CID 1427599
N-(furan-2-ylmethyl)-N-[3-phenyl-3-(4-propan-2-yloxyphenyl)propyl]propanamide
CID 3841014
N-benzyl-N-butylpropanamide
CID 12502571
N-benzyl-N-(2-chloroethyl)propanamide
CID 63390961
N-[3-(furan-2-yl)-3-(4-methylphenyl)propyl]-N-(1-thiophen-2-ylethyl)acetamide
CID 3838226
N-[3-(furan-2-yl)-3-phenylpropyl]-N-[(4-methoxyphenyl)methyl]furan-3-carboxamide
CID 2937179
N-[3-(1,3-benzodioxol-5-yl)-3-(2-methoxyphenyl)propyl]-N-benzylpropanamide
CID 2920302
N-[2-[benzyl(furan-2-ylmethyl)amino]-2-oxoethyl]-4-methyl-N-propylbenzamide
CID 3596156
N-[(3R)-3-(2-methoxyphenyl)-3-(4-methoxyphenyl)propyl]-N-[(4-propan-2-yloxyphenyl)methyl]propanamide
CID 25426230

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-[3-(furan-2-yl)-3-(4-methylphenyl)propyl]propanamide?
The IUPAC name of N-benzyl-N-[3-(furan-2-yl)-3-(4-methylphenyl)propyl]propanamide (CID 2938663) is N-benzyl-N-[3-(furan-2-yl)-3-(4-methylphenyl)propyl]propanamide.
What is the SMILES notation for N-benzyl-N-[3-(furan-2-yl)-3-(4-methylphenyl)propyl]propanamide?
The canonical SMILES for N-benzyl-N-[3-(furan-2-yl)-3-(4-methylphenyl)propyl]propanamide is CCC(=O)N(CCC(c1ccc(C)cc1)c1ccco1)Cc1ccccc1.
What is the InChIKey of N-benzyl-N-[3-(furan-2-yl)-3-(4-methylphenyl)propyl]propanamide?
The InChIKey is FWBGYWKXBRTCKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27NO2/c1-3-24(26)25(18-20-8-5-4-6-9-20)16-15-22(23-10-7-17-27-23)21-13-11-19(2)12-14-21/h4-14,17,22H,3,15-16,18H2,1-2H3.
What are the key properties of N-benzyl-N-[3-(furan-2-yl)-3-(4-methylphenyl)propyl]propanamide?
N-benzyl-N-[3-(furan-2-yl)-3-(4-methylphenyl)propyl]propanamide has a molecular weight of 361.49 g/mol, XLogP of 5.55, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-[3-(furan-2-yl)-3-(4-methylphenyl)propyl]propanamide is sourced from PubChem (CID 2938663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).