2-(benzimidazol-1-yl)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide

C17H18N4O3 — CID 90624784

IUPAC2-(benzimidazol-1-yl)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide
SMILESO=C(Cn1cnc2ccccc21)NCC(O)Cn1ccccc1=O
InChIInChI=1S/C17H18N4O3/c22-13(10-20-8-4-3-7-17(20)24)9-18-16(23)11-21-12-19-14-5-1-2-6-15(14)21/h1-8,12-13,22H,9-11H2,(H,18,23)
InChIKeyKVCQFYJCFQTEOV-UHFFFAOYSA-N
MW326.36 g/mol
LogP0.38
Rot. Bonds6

About 2-(benzimidazol-1-yl)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide

2-(benzimidazol-1-yl)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide (PubChem CID 90624784) has the molecular formula C17H18N4O3 and a molecular weight of 326.36 g/mol. Its IUPAC name is 2-(benzimidazol-1-yl)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide.

Molecular Properties

Compound Name2-(benzimidazol-1-yl)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide
PubChem CID90624784
Molecular FormulaC17H18N4O3
Molecular Weight326.36 g/mol
Exact Mass326.14
IUPAC Name2-(benzimidazol-1-yl)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide
SMILESO=C(Cn1cnc2ccccc21)NCC(O)Cn1ccccc1=O
InChIInChI=1S/C17H18N4O3/c22-13(10-20-8-4-3-7-17(20)24)9-18-16(23)11-21-12-19-14-5-1-2-6-15(14)21/h1-8,12-13,22H,9-11H2,(H,18,23)
InChIKeyKVCQFYJCFQTEOV-UHFFFAOYSA-N
XLogP0.38
TPSA89.15 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.36
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-pyrazol-1-ylacetamide
CID 90624986
2-chloro-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide
CID 90624843
N-[(2S)-2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-phenylacetamide
CID 99903624
4-[[2-(benzimidazol-1-yl)acetyl]amino]-3-methylbutanoic acid
CID 81064314
4-chloro-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]butanamide
CID 90624845
2-(benzimidazol-1-yl)-N-[(2S)-2-phenylpropyl]acetamide
CID 51646878
(2S)-4-[[2-(benzimidazol-1-yl)acetyl]amino]-2-hydroxybutanoic acid
CID 107833952
2-(benzimidazol-1-yl)-N-propylacetamide
CID 17028466
2-(benzimidazol-1-yl)-N-(1,3-dihydroxypropan-2-yl)acetamide
CID 65315452
2-(4-fluorophenoxy)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide
CID 90624911
2-cyclopentyl-N-[(2S)-2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide
CID 97428898
1-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-3-propan-2-ylurea
CID 90625121

Frequently Asked Questions

What is the IUPAC name of 2-(benzimidazol-1-yl)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide?
The IUPAC name of 2-(benzimidazol-1-yl)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide (CID 90624784) is 2-(benzimidazol-1-yl)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide.
What is the SMILES notation for 2-(benzimidazol-1-yl)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide?
The canonical SMILES for 2-(benzimidazol-1-yl)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide is O=C(Cn1cnc2ccccc21)NCC(O)Cn1ccccc1=O.
What is the InChIKey of 2-(benzimidazol-1-yl)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide?
The InChIKey is KVCQFYJCFQTEOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O3/c22-13(10-20-8-4-3-7-17(20)24)9-18-16(23)11-21-12-19-14-5-1-2-6-15(14)21/h1-8,12-13,22H,9-11H2,(H,18,23).
What are the key properties of 2-(benzimidazol-1-yl)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide?
2-(benzimidazol-1-yl)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide has a molecular weight of 326.36 g/mol, XLogP of 0.38, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzimidazol-1-yl)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide is sourced from PubChem (CID 90624784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).