(2R)-N-(2-methyl-3H-benzimidazol-5-yl)-2-(2-oxopyrrolidin-1-yl)propanamide

C15H18N4O2 — CID 92604255

IUPAC(2R)-N-(2-methyl-3H-benzimidazol-5-yl)-2-(2-oxopyrrolidin-1-yl)propanamide
SMILESCc1nc2ccc(NC(=O)[C@@H](C)N3CCCC3=O)cc2[nH]1
InChIInChI=1S/C15H18N4O2/c1-9(19-7-3-4-14(19)20)15(21)18-11-5-6-12-13(8-11)17-10(2)16-12/h5-6,8-9H,3-4,7H2,1-2H3,(H,16,17)(H,18,21)/t9-/m1/s1
InChIKeyJKIGOZDVJYANFO-SECBINFHSA-N
MW286.34 g/mol
LogP1.82
Rot. Bonds3

About (2R)-N-(2-methyl-3H-benzimidazol-5-yl)-2-(2-oxopyrrolidin-1-yl)propanamide

(2R)-N-(2-methyl-3H-benzimidazol-5-yl)-2-(2-oxopyrrolidin-1-yl)propanamide (PubChem CID 92604255) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is (2R)-N-(2-methyl-3H-benzimidazol-5-yl)-2-(2-oxopyrrolidin-1-yl)propanamide.

Molecular Properties

Compound Name(2R)-N-(2-methyl-3H-benzimidazol-5-yl)-2-(2-oxopyrrolidin-1-yl)propanamide
PubChem CID92604255
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC Name(2R)-N-(2-methyl-3H-benzimidazol-5-yl)-2-(2-oxopyrrolidin-1-yl)propanamide
SMILESCc1nc2ccc(NC(=O)[C@@H](C)N3CCCC3=O)cc2[nH]1
InChIInChI=1S/C15H18N4O2/c1-9(19-7-3-4-14(19)20)15(21)18-11-5-6-12-13(8-11)17-10(2)16-12/h5-6,8-9H,3-4,7H2,1-2H3,(H,16,17)(H,18,21)/t9-/m1/s1
InChIKeyJKIGOZDVJYANFO-SECBINFHSA-N
XLogP1.82
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-difluoro-N-(2-methyl-3H-benzimidazol-5-yl)acetamide
CID 103515060
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CID 79195442
2-(azetidin-3-yl)-N-(2-methyl-3H-benzimidazol-5-yl)propanamide
CID 116675730
2-(hydroxymethyl)-3-methyl-N-(2-methyl-3H-benzimidazol-5-yl)butanamide
CID 115187183
(2S)-2-amino-N-(2-methyl-3H-benzimidazol-5-yl)butanamide
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2-(butan-2-ylamino)-N-(2-methyl-3H-benzimidazol-5-yl)acetamide
CID 60853212
N-(2-methyl-3H-benzimidazol-5-yl)cyclopropanecarboxamide
CID 53276569
tert-butyl 4-[2-(2-oxopyrrolidin-1-yl)propanoylamino]benzoate
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N-methyl-3-[2-(2-oxoazepan-1-yl)propanoylamino]benzamide
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N-[4-(2,3-dimethylimidazo[1,2-b][1,2,4]triazin-6-yl)phenyl]-2-(2-oxopyrrolidin-1-yl)propanamide
CID 46981693
N-(2-methyl-3H-benzimidazol-5-yl)-3-oxobutanamide
CID 61250337
N-(2-methyl-1,3-benzoxazol-6-yl)-2-(2-oxopyrrolidin-1-yl)butanamide
CID 71991480

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2-methyl-3H-benzimidazol-5-yl)-2-(2-oxopyrrolidin-1-yl)propanamide?
The IUPAC name of (2R)-N-(2-methyl-3H-benzimidazol-5-yl)-2-(2-oxopyrrolidin-1-yl)propanamide (CID 92604255) is (2R)-N-(2-methyl-3H-benzimidazol-5-yl)-2-(2-oxopyrrolidin-1-yl)propanamide.
What is the SMILES notation for (2R)-N-(2-methyl-3H-benzimidazol-5-yl)-2-(2-oxopyrrolidin-1-yl)propanamide?
The canonical SMILES for (2R)-N-(2-methyl-3H-benzimidazol-5-yl)-2-(2-oxopyrrolidin-1-yl)propanamide is Cc1nc2ccc(NC(=O)[C@@H](C)N3CCCC3=O)cc2[nH]1.
What is the InChIKey of (2R)-N-(2-methyl-3H-benzimidazol-5-yl)-2-(2-oxopyrrolidin-1-yl)propanamide?
The InChIKey is JKIGOZDVJYANFO-SECBINFHSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-9(19-7-3-4-14(19)20)15(21)18-11-5-6-12-13(8-11)17-10(2)16-12/h5-6,8-9H,3-4,7H2,1-2H3,(H,16,17)(H,18,21)/t9-/m1/s1.
What are the key properties of (2R)-N-(2-methyl-3H-benzimidazol-5-yl)-2-(2-oxopyrrolidin-1-yl)propanamide?
(2R)-N-(2-methyl-3H-benzimidazol-5-yl)-2-(2-oxopyrrolidin-1-yl)propanamide has a molecular weight of 286.34 g/mol, XLogP of 1.82, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2-methyl-3H-benzimidazol-5-yl)-2-(2-oxopyrrolidin-1-yl)propanamide is sourced from PubChem (CID 92604255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).