N-[3H-benzimidazol-5-yl(phenyl)methyl]-3-(3-methoxyphenyl)propanamide

C24H23N3O2 — CID 24666701

IUPACN-[3H-benzimidazol-5-yl(phenyl)methyl]-3-(3-methoxyphenyl)propanamide
SMILESCOc1cccc(CCC(=O)NC(c2ccccc2)c2ccc3nc[nH]c3c2)c1
InChIInChI=1S/C24H23N3O2/c1-29-20-9-5-6-17(14-20)10-13-23(28)27-24(18-7-3-2-4-8-18)19-11-12-21-22(15-19)26-16-25-21/h2-9,11-12,14-16,24H,10,13H2,1H3,(H,25,26)(H,27,28)
InChIKeyCKUCZSYTOHWWBP-UHFFFAOYSA-N
MW385.47 g/mol
LogP4.41
Rot. Bonds7

About N-[3H-benzimidazol-5-yl(phenyl)methyl]-3-(3-methoxyphenyl)propanamide

N-[3H-benzimidazol-5-yl(phenyl)methyl]-3-(3-methoxyphenyl)propanamide (PubChem CID 24666701) has the molecular formula C24H23N3O2 and a molecular weight of 385.47 g/mol. Its IUPAC name is N-[3H-benzimidazol-5-yl(phenyl)methyl]-3-(3-methoxyphenyl)propanamide.

Molecular Properties

Compound NameN-[3H-benzimidazol-5-yl(phenyl)methyl]-3-(3-methoxyphenyl)propanamide
PubChem CID24666701
Molecular FormulaC24H23N3O2
Molecular Weight385.47 g/mol
Exact Mass385.18
IUPAC NameN-[3H-benzimidazol-5-yl(phenyl)methyl]-3-(3-methoxyphenyl)propanamide
SMILESCOc1cccc(CCC(=O)NC(c2ccccc2)c2ccc3nc[nH]c3c2)c1
InChIInChI=1S/C24H23N3O2/c1-29-20-9-5-6-17(14-20)10-13-23(28)27-24(18-7-3-2-4-8-18)19-11-12-21-22(15-19)26-16-25-21/h2-9,11-12,14-16,24H,10,13H2,1H3,(H,25,26)(H,27,28)
InChIKeyCKUCZSYTOHWWBP-UHFFFAOYSA-N
XLogP4.41
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.47
LogP ≤ 54.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(S)-3H-benzimidazol-5-yl(phenyl)methyl]-3-(3,5-dimethoxyphenyl)propanamide
CID 25474476
N-[3H-benzimidazol-5-yl(phenyl)methyl]-2-(4-methoxyphenyl)acetamide
CID 86916761
N-[3H-benzimidazol-5-yl(phenyl)methyl]-4-phenylbutanamide
CID 78876519
N-[3H-benzimidazol-5-yl(phenyl)methyl]-2-hydroxy-4-methoxybenzamide
CID 112809173
N-[3H-benzimidazol-5-yl(phenyl)methyl]-2-(2-methylphenoxy)acetamide
CID 42883479
N-[3H-benzimidazol-5-yl(phenyl)methyl]-2-bromo-5-methoxybenzamide
CID 78836790
N-[(S)-(4-methoxyphenyl)-phenylmethyl]-3-phenylpropanamide
CID 891641
2-(3-methoxyphenyl)-N-[(4-methoxyphenyl)-phenylmethyl]acetamide
CID 51187291
N-[2-[[3H-benzimidazol-5-yl(phenyl)methyl]amino]-2-oxoethyl]-2-(3-fluorophenyl)acetamide
CID 78886875
N-[3H-benzimidazol-5-yl(phenyl)methyl]-4-(4-chlorophenyl)-4-oxobutanamide
CID 78839236
N-[3H-benzimidazol-5-yl(phenyl)methyl]-3-(4,7-dimethyl-2-oxochromen-3-yl)propanamide
CID 24621615
3-(4-methoxyphenyl)-N-[(4-methylphenyl)-phenylmethyl]propanamide
CID 133220674

Frequently Asked Questions

What is the IUPAC name of N-[3H-benzimidazol-5-yl(phenyl)methyl]-3-(3-methoxyphenyl)propanamide?
The IUPAC name of N-[3H-benzimidazol-5-yl(phenyl)methyl]-3-(3-methoxyphenyl)propanamide (CID 24666701) is N-[3H-benzimidazol-5-yl(phenyl)methyl]-3-(3-methoxyphenyl)propanamide.
What is the SMILES notation for N-[3H-benzimidazol-5-yl(phenyl)methyl]-3-(3-methoxyphenyl)propanamide?
The canonical SMILES for N-[3H-benzimidazol-5-yl(phenyl)methyl]-3-(3-methoxyphenyl)propanamide is COc1cccc(CCC(=O)NC(c2ccccc2)c2ccc3nc[nH]c3c2)c1.
What is the InChIKey of N-[3H-benzimidazol-5-yl(phenyl)methyl]-3-(3-methoxyphenyl)propanamide?
The InChIKey is CKUCZSYTOHWWBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O2/c1-29-20-9-5-6-17(14-20)10-13-23(28)27-24(18-7-3-2-4-8-18)19-11-12-21-22(15-19)26-16-25-21/h2-9,11-12,14-16,24H,10,13H2,1H3,(H,25,26)(H,27,28).
What are the key properties of N-[3H-benzimidazol-5-yl(phenyl)methyl]-3-(3-methoxyphenyl)propanamide?
N-[3H-benzimidazol-5-yl(phenyl)methyl]-3-(3-methoxyphenyl)propanamide has a molecular weight of 385.47 g/mol, XLogP of 4.41, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3H-benzimidazol-5-yl(phenyl)methyl]-3-(3-methoxyphenyl)propanamide is sourced from PubChem (CID 24666701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).