N-(1H-imidazol-2-yl)-3-pyridin-2-ylpropanamide

C11H12N4O — CID 78981098

IUPACN-(1H-imidazol-2-yl)-3-pyridin-2-ylpropanamide
SMILESO=C(CCc1ccccn1)Nc1ncc[nH]1
InChIInChI=1S/C11H12N4O/c16-10(15-11-13-7-8-14-11)5-4-9-3-1-2-6-12-9/h1-3,6-8H,4-5H2,(H2,13,14,15,16)
InChIKeyKHUAJZGJPYFQKT-UHFFFAOYSA-N
MW216.24 g/mol
LogP1.38
Rot. Bonds4

About N-(1H-imidazol-2-yl)-3-pyridin-2-ylpropanamide

N-(1H-imidazol-2-yl)-3-pyridin-2-ylpropanamide (PubChem CID 78981098) has the molecular formula C11H12N4O and a molecular weight of 216.24 g/mol. Its IUPAC name is N-(1H-imidazol-2-yl)-3-pyridin-2-ylpropanamide.

Molecular Properties

Compound NameN-(1H-imidazol-2-yl)-3-pyridin-2-ylpropanamide
PubChem CID78981098
Molecular FormulaC11H12N4O
Molecular Weight216.24 g/mol
Exact Mass216.10
IUPAC NameN-(1H-imidazol-2-yl)-3-pyridin-2-ylpropanamide
SMILESO=C(CCc1ccccn1)Nc1ncc[nH]1
InChIInChI=1S/C11H12N4O/c16-10(15-11-13-7-8-14-11)5-4-9-3-1-2-6-12-9/h1-3,6-8H,4-5H2,(H2,13,14,15,16)
InChIKeyKHUAJZGJPYFQKT-UHFFFAOYSA-N
XLogP1.38
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-hydroxyphenyl)-3-pyridin-2-ylpropanamide
CID 80743821
N-methyl-3-pyridin-2-ylpropanamide
CID 14093010
N-(2,6-difluorophenyl)-3-pyridin-2-ylpropanamide
CID 110389270
N-(6-acetamido-2-pyridinyl)-3-pyridin-2-ylpropanamide
CID 101146103
2-(3-pyridin-2-ylpropanoylamino)benzoic acid
CID 110468304
3-pyridin-2-yl-N-pyridin-3-ylpropanamide
CID 47468155
3-pyridin-2-yl-N-(2,4,6-trimethylphenyl)propanamide
CID 47468107
2-chloro-6-[3-(1H-imidazol-2-ylamino)-3-oxopropyl]benzamide
CID 173125449
3-(3-cyanophenyl)-N-(1H-imidazol-2-yl)propanamide
CID 70138927
3-hydroxy-2-(3-pyridin-2-ylpropanoylamino)propanoic acid
CID 114289566
3-(2-fluorophenyl)sulfanyl-N-(1H-imidazol-2-yl)propanamide
CID 55212765
3-(3-chloro-4-methylphenyl)-N-(1H-imidazol-2-yl)propanamide
CID 60967807

Frequently Asked Questions

What is the IUPAC name of N-(1H-imidazol-2-yl)-3-pyridin-2-ylpropanamide?
The IUPAC name of N-(1H-imidazol-2-yl)-3-pyridin-2-ylpropanamide (CID 78981098) is N-(1H-imidazol-2-yl)-3-pyridin-2-ylpropanamide.
What is the SMILES notation for N-(1H-imidazol-2-yl)-3-pyridin-2-ylpropanamide?
The canonical SMILES for N-(1H-imidazol-2-yl)-3-pyridin-2-ylpropanamide is O=C(CCc1ccccn1)Nc1ncc[nH]1.
What is the InChIKey of N-(1H-imidazol-2-yl)-3-pyridin-2-ylpropanamide?
The InChIKey is KHUAJZGJPYFQKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O/c16-10(15-11-13-7-8-14-11)5-4-9-3-1-2-6-12-9/h1-3,6-8H,4-5H2,(H2,13,14,15,16).
What are the key properties of N-(1H-imidazol-2-yl)-3-pyridin-2-ylpropanamide?
N-(1H-imidazol-2-yl)-3-pyridin-2-ylpropanamide has a molecular weight of 216.24 g/mol, XLogP of 1.38, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-imidazol-2-yl)-3-pyridin-2-ylpropanamide is sourced from PubChem (CID 78981098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).