2-(2-methoxyphenyl)-N-[2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propyl]acetamide

C23H29N3O2 — CID 91821901

IUPAC2-(2-methoxyphenyl)-N-[2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propyl]acetamide
SMILESCOc1ccccc1CC(=O)NC(c1nc2ccccc2n1C(C)C)C(C)C
InChIInChI=1S/C23H29N3O2/c1-15(2)22(25-21(27)14-17-10-6-9-13-20(17)28-5)23-24-18-11-7-8-12-19(18)26(23)16(3)4/h6-13,15-16,22H,14H2,1-5H3,(H,25,27)
InChIKeyZAPYDWQALQXMDE-UHFFFAOYSA-N
MW379.50 g/mol
LogP4.68
Rot. Bonds7

About 2-(2-methoxyphenyl)-N-[2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propyl]acetamide

2-(2-methoxyphenyl)-N-[2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propyl]acetamide (PubChem CID 91821901) has the molecular formula C23H29N3O2 and a molecular weight of 379.50 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-N-[2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propyl]acetamide.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-N-[2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propyl]acetamide
PubChem CID91821901
Molecular FormulaC23H29N3O2
Molecular Weight379.50 g/mol
Exact Mass379.23
IUPAC Name2-(2-methoxyphenyl)-N-[2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propyl]acetamide
SMILESCOc1ccccc1CC(=O)NC(c1nc2ccccc2n1C(C)C)C(C)C
InChIInChI=1S/C23H29N3O2/c1-15(2)22(25-21(27)14-17-10-6-9-13-20(17)28-5)23-24-18-11-7-8-12-19(18)26(23)16(3)4/h6-13,15-16,22H,14H2,1-5H3,(H,25,27)
InChIKeyZAPYDWQALQXMDE-UHFFFAOYSA-N
XLogP4.68
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.50
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxyphenyl)-N-[2-methyl-1-(1-methylbenzimidazol-2-yl)propyl]acetamide
CID 91823296
N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]-2-(2-methoxyphenyl)acetamide
CID 8928025
2-(4-methoxyindol-1-yl)-N-[(1S)-2-methyl-1-(1-methylbenzimidazol-2-yl)propyl]acetamide
CID 91639450
2-methoxy-N-[2-methyl-1-(1-methylbenzimidazol-2-yl)propyl]benzamide
CID 121240654
N-[(1S)-2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propyl]-2-(4-pyrrol-1-ylthian-4-yl)acetamide
CID 91640796
N-[2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propyl]-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide
CID 91822481
N-[(1S)-2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propyl]-3-(4-oxo-1,2,3-benzotriazin-3-yl)propanamide
CID 91640901
N-[(1R)-2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propyl]-2-[(1R)-3-oxo-1,2-dihydroisoindol-1-yl]acetamide
CID 125400617
N-[1-[1-[(2-methoxyphenyl)methyl]benzimidazol-2-yl]ethyl]prop-2-enamide
CID 16969979
N-[1-[1-[(2-methoxyphenyl)methyl]benzimidazol-2-yl]ethyl]butanamide
CID 16968736
N-[(1R)-1-(1-propan-2-ylbenzimidazol-2-yl)ethyl]butanamide
CID 751172
N-[1-(1-propan-2-ylbenzimidazol-2-yl)ethyl]butanamide
CID 4592510

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-N-[2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propyl]acetamide?
The IUPAC name of 2-(2-methoxyphenyl)-N-[2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propyl]acetamide (CID 91821901) is 2-(2-methoxyphenyl)-N-[2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propyl]acetamide.
What is the SMILES notation for 2-(2-methoxyphenyl)-N-[2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propyl]acetamide?
The canonical SMILES for 2-(2-methoxyphenyl)-N-[2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propyl]acetamide is COc1ccccc1CC(=O)NC(c1nc2ccccc2n1C(C)C)C(C)C.
What is the InChIKey of 2-(2-methoxyphenyl)-N-[2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propyl]acetamide?
The InChIKey is ZAPYDWQALQXMDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O2/c1-15(2)22(25-21(27)14-17-10-6-9-13-20(17)28-5)23-24-18-11-7-8-12-19(18)26(23)16(3)4/h6-13,15-16,22H,14H2,1-5H3,(H,25,27).
What are the key properties of 2-(2-methoxyphenyl)-N-[2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propyl]acetamide?
2-(2-methoxyphenyl)-N-[2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propyl]acetamide has a molecular weight of 379.50 g/mol, XLogP of 4.68, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-N-[2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propyl]acetamide is sourced from PubChem (CID 91821901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).