1,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrazole-4-carboxamide

C11H15N5O — CID 119063751

IUPAC1,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrazole-4-carboxamide
SMILESCc1c(C(=O)NCc2nccn2C)cnn1C
InChIInChI=1S/C11H15N5O/c1-8-9(6-14-16(8)3)11(17)13-7-10-12-4-5-15(10)2/h4-6H,7H2,1-3H3,(H,13,17)
InChIKeyFGCXWRGVQPDCNU-UHFFFAOYSA-N
MW233.28 g/mol
LogP0.39
Rot. Bonds3

About 1,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrazole-4-carboxamide

1,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrazole-4-carboxamide (PubChem CID 119063751) has the molecular formula C11H15N5O and a molecular weight of 233.28 g/mol. Its IUPAC name is 1,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrazole-4-carboxamide.

Molecular Properties

Compound Name1,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrazole-4-carboxamide
PubChem CID119063751
Molecular FormulaC11H15N5O
Molecular Weight233.28 g/mol
Exact Mass233.13
IUPAC Name1,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrazole-4-carboxamide
SMILESCc1c(C(=O)NCc2nccn2C)cnn1C
InChIInChI=1S/C11H15N5O/c1-8-9(6-14-16(8)3)11(17)13-7-10-12-4-5-15(10)2/h4-6H,7H2,1-3H3,(H,13,17)
InChIKeyFGCXWRGVQPDCNU-UHFFFAOYSA-N
XLogP0.39
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.28
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(azetidine-1-carbonyl)-1-methyl-N-(1-pyrazin-2-ylimidazol-4-yl)pyrazole-5-carboxamide
CID 165415278
(5-methyl-1H-pyrazol-4-yl)-[4-[(1-propan-2-ylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]methanone
CID 56778649
3-[1-(2-methoxyethyl)-1H-imidazol-2-yl]-1-[(3-methyl-1-propyl-1H-pyrazol-4-yl)carbonyl]piperidine
CID 72858204
3-[1-(cyclobutylmethyl)-1H-imidazol-2-yl]-1-[(1,3-dimethyl-1H-pyrazol-4-yl)carbonyl]piperidine
CID 72867903
2-(dimethylamino)-N-[2-(5-methylpyrazol-1-yl)ethyl]pyrimidine-5-carboxamide
CID 92562801
N-[1-[2-(cyclopentylamino)-2-oxoethyl]pyrazol-4-yl]-4-methylpyrimidine-5-carboxamide
CID 95806245
N-[(7-ethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methyl]-1-methylpyrazole-4-carboxamide
CID 97467591
(1-Methylpyrazol-4-yl)-[3-(4-methylpyrimidin-2-yl)pyrrolidin-1-yl]methanone
CID 118740310
N-{4-[(Dimethylamino)methyl]-1-(pyrimidin-2-YL)pyrrolidin-3-YL}-1-ethyl-5-methyl-1H-pyrazole-4-carboxamide
CID 91911103
1-(1-acetylpiperidin-4-yl)-2,5-dimethyl-N-[(3-methyl-1-propylpyrazol-4-yl)methyl]imidazole-4-carboxamide
CID 53181635
N-[2-(1-cyclopropyl-5-methyl-1H-imidazol-2-yl)ethyl]-1-ethyl-1H-pyrazole-3-carboxamide
CID 91911663
N-{2-[1-(cyclopropylmethyl)-5-methyl-1H-imidazol-2-yl]ethyl}-1-methyl-1H-pyrazole-5-carboxamide
CID 91911718

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrazole-4-carboxamide?
The IUPAC name of 1,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrazole-4-carboxamide (CID 119063751) is 1,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrazole-4-carboxamide.
What is the SMILES notation for 1,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrazole-4-carboxamide?
The canonical SMILES for 1,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrazole-4-carboxamide is Cc1c(C(=O)NCc2nccn2C)cnn1C.
What is the InChIKey of 1,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrazole-4-carboxamide?
The InChIKey is FGCXWRGVQPDCNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-8-9(6-14-16(8)3)11(17)13-7-10-12-4-5-15(10)2/h4-6H,7H2,1-3H3,(H,13,17).
What are the key properties of 1,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrazole-4-carboxamide?
1,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrazole-4-carboxamide has a molecular weight of 233.28 g/mol, XLogP of 0.39, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-N-[(1-methylimidazol-2-yl)methyl]pyrazole-4-carboxamide is sourced from PubChem (CID 119063751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).