N-(2-acetamidopyrido[1,2-a]benzimidazol-8-yl)acetamide

C15H14N4O2 — CID 12782375

IUPACN-(2-acetamidopyrido[1,2-a]benzimidazol-8-yl)acetamide
SMILESCC(=O)Nc1ccc2nc3ccc(NC(C)=O)cn3c2c1
InChIInChI=1S/C15H14N4O2/c1-9(20)16-11-3-5-13-14(7-11)19-8-12(17-10(2)21)4-6-15(19)18-13/h3-8H,1-2H3,(H,16,20)(H,17,21)
InChIKeyWJAKBYVHIKQXJA-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.40
Rot. Bonds2

About N-(2-acetamidopyrido[1,2-a]benzimidazol-8-yl)acetamide

N-(2-acetamidopyrido[1,2-a]benzimidazol-8-yl)acetamide (PubChem CID 12782375) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is N-(2-acetamidopyrido[1,2-a]benzimidazol-8-yl)acetamide.

Molecular Properties

Compound NameN-(2-acetamidopyrido[1,2-a]benzimidazol-8-yl)acetamide
PubChem CID12782375
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC NameN-(2-acetamidopyrido[1,2-a]benzimidazol-8-yl)acetamide
SMILESCC(=O)Nc1ccc2nc3ccc(NC(C)=O)cn3c2c1
InChIInChI=1S/C15H14N4O2/c1-9(20)16-11-3-5-13-14(7-11)19-8-12(17-10(2)21)4-6-15(19)18-13/h3-8H,1-2H3,(H,16,20)(H,17,21)
InChIKeyWJAKBYVHIKQXJA-UHFFFAOYSA-N
XLogP2.40
TPSA75.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-bromo-3-methylimidazo[1,2-a]pyridin-6-yl)acetamide
CID 115268758
N-(3-hydroxybenzotriazol-5-yl)acetamide
CID 57317283
N-(2-acetamido-1,3-benzoxazol-6-yl)acetamide
CID 952763
N-[3-(1-iodoethyl)-2-(trifluoromethyl)benzimidazol-5-yl]acetamide
CID 143549922
N-(1,3-benzoxazol-6-yl)acetamide
CID 54228397
N-(5-methylindolo[3,2-b]quinolin-7-yl)acetamide
CID 15907594
N-(3-bromoquinolin-6-yl)acetamide
CID 15378467
N-(3-acetamidophenyl)-5-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 26114454
2-[(6-acetamido-1,3-benzothiazol-2-yl)sulfanyl]acetic acid
CID 653086
N-[3-[(2-chlorophenyl)methyl]-2-propylbenzimidazol-5-yl]acetamide
CID 22620334
N-[3-(3-amino-6-chloroimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide
CID 82530174
[6-amino-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methanol;N-[2-(4-chlorophenyl)-3-(hydroxymethyl)imidazo[1,2-a]pyridin-6-yl]acetamide
CID 67122989

Frequently Asked Questions

What is the IUPAC name of N-(2-acetamidopyrido[1,2-a]benzimidazol-8-yl)acetamide?
The IUPAC name of N-(2-acetamidopyrido[1,2-a]benzimidazol-8-yl)acetamide (CID 12782375) is N-(2-acetamidopyrido[1,2-a]benzimidazol-8-yl)acetamide.
What is the SMILES notation for N-(2-acetamidopyrido[1,2-a]benzimidazol-8-yl)acetamide?
The canonical SMILES for N-(2-acetamidopyrido[1,2-a]benzimidazol-8-yl)acetamide is CC(=O)Nc1ccc2nc3ccc(NC(C)=O)cn3c2c1.
What is the InChIKey of N-(2-acetamidopyrido[1,2-a]benzimidazol-8-yl)acetamide?
The InChIKey is WJAKBYVHIKQXJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-9(20)16-11-3-5-13-14(7-11)19-8-12(17-10(2)21)4-6-15(19)18-13/h3-8H,1-2H3,(H,16,20)(H,17,21).
What are the key properties of N-(2-acetamidopyrido[1,2-a]benzimidazol-8-yl)acetamide?
N-(2-acetamidopyrido[1,2-a]benzimidazol-8-yl)acetamide has a molecular weight of 282.30 g/mol, XLogP of 2.40, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetamidopyrido[1,2-a]benzimidazol-8-yl)acetamide is sourced from PubChem (CID 12782375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).