N-[(2,3-dimethylimidazol-4-yl)methyl]cyclopropanecarboxamide

C10H15N3O — CID 164659423

IUPACN-[(2,3-dimethylimidazol-4-yl)methyl]cyclopropanecarboxamide
SMILESCc1ncc(CNC(=O)C2CC2)n1C
InChIInChI=1S/C10H15N3O/c1-7-11-5-9(13(7)2)6-12-10(14)8-3-4-8/h5,8H,3-4,6H2,1-2H3,(H,12,14)
InChIKeyYDRZDFPJXXGTKH-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.75
Rot. Bonds3

About N-[(2,3-dimethylimidazol-4-yl)methyl]cyclopropanecarboxamide

N-[(2,3-dimethylimidazol-4-yl)methyl]cyclopropanecarboxamide (PubChem CID 164659423) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is N-[(2,3-dimethylimidazol-4-yl)methyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(2,3-dimethylimidazol-4-yl)methyl]cyclopropanecarboxamide
PubChem CID164659423
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC NameN-[(2,3-dimethylimidazol-4-yl)methyl]cyclopropanecarboxamide
SMILESCc1ncc(CNC(=O)C2CC2)n1C
InChIInChI=1S/C10H15N3O/c1-7-11-5-9(13(7)2)6-12-10(14)8-3-4-8/h5,8H,3-4,6H2,1-2H3,(H,12,14)
InChIKeyYDRZDFPJXXGTKH-UHFFFAOYSA-N
XLogP0.75
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-methyl-1,2,4-triazol-3-yl)methyl]cyclopropanecarboxamide
CID 103883571
methyl 2-(2,3-dimethylimidazol-4-yl)acetate
CID 146238760
(3S)-1-acetyl-N-[(3-methyl-2-methylsulfanylimidazol-4-yl)methyl]piperidine-3-carboxamide
CID 97202862
N-[(4-bromo-1-methylpyrazol-5-yl)methyl]cyclopropanecarboxamide
CID 19294775
N-[(3-methyl-2-methylsulfanylimidazol-4-yl)methyl]-1-propan-2-ylpiperidine-3-carboxamide
CID 72940468
cis-(1R,3S)-3-[(2,5-dimethylpyrazol-3-yl)methylcarbamoyl]cyclopentane-1-carboxylic acid
CID 74241443
1-N-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-3-ylmethyl)-4-N,4-N-dimethylcyclohexane-1,4-dicarboxamide
CID 166389980
N-[(2,4-dimethyl-1,3-oxazol-5-yl)methyl]cyclopropanecarboxamide
CID 110714751
N-[(1,5-dimethylpyrrol-2-yl)methyl]-1-[5-(trifluoromethyl)-2-pyridinyl]piperidine-4-carboxamide
CID 17424947
1-(2,2-dimethylpropanoyl)-N-[[6-(2-methylimidazol-1-yl)-3-pyridinyl]methyl]piperidine-4-carboxamide
CID 87023017
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]cyclopropanecarboxamide
CID 103623190
N-[[7-(6-methylpyridine-2-carbonyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-3-yl]methyl]cyclopropanecarboxamide
CID 97384473

Frequently Asked Questions

What is the IUPAC name of N-[(2,3-dimethylimidazol-4-yl)methyl]cyclopropanecarboxamide?
The IUPAC name of N-[(2,3-dimethylimidazol-4-yl)methyl]cyclopropanecarboxamide (CID 164659423) is N-[(2,3-dimethylimidazol-4-yl)methyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[(2,3-dimethylimidazol-4-yl)methyl]cyclopropanecarboxamide?
The canonical SMILES for N-[(2,3-dimethylimidazol-4-yl)methyl]cyclopropanecarboxamide is Cc1ncc(CNC(=O)C2CC2)n1C.
What is the InChIKey of N-[(2,3-dimethylimidazol-4-yl)methyl]cyclopropanecarboxamide?
The InChIKey is YDRZDFPJXXGTKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-7-11-5-9(13(7)2)6-12-10(14)8-3-4-8/h5,8H,3-4,6H2,1-2H3,(H,12,14).
What are the key properties of N-[(2,3-dimethylimidazol-4-yl)methyl]cyclopropanecarboxamide?
N-[(2,3-dimethylimidazol-4-yl)methyl]cyclopropanecarboxamide has a molecular weight of 193.25 g/mol, XLogP of 0.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,3-dimethylimidazol-4-yl)methyl]cyclopropanecarboxamide is sourced from PubChem (CID 164659423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).