(3-methylimidazol-4-yl)-(2-methylpyrazol-3-yl)methanone

C9H10N4O — CID 82895472

IUPAC(3-methylimidazol-4-yl)-(2-methylpyrazol-3-yl)methanone
SMILESCn1cncc1C(=O)c1ccnn1C
InChIInChI=1S/C9H10N4O/c1-12-6-10-5-8(12)9(14)7-3-4-11-13(7)2/h3-6H,1-2H3
InChIKeyWROJDQPBZBIBDS-UHFFFAOYSA-N
MW190.21 g/mol
LogP0.38
Rot. Bonds2

About (3-methylimidazol-4-yl)-(2-methylpyrazol-3-yl)methanone

(3-methylimidazol-4-yl)-(2-methylpyrazol-3-yl)methanone (PubChem CID 82895472) has the molecular formula C9H10N4O and a molecular weight of 190.21 g/mol. Its IUPAC name is (3-methylimidazol-4-yl)-(2-methylpyrazol-3-yl)methanone.

Molecular Properties

Compound Name(3-methylimidazol-4-yl)-(2-methylpyrazol-3-yl)methanone
PubChem CID82895472
Molecular FormulaC9H10N4O
Molecular Weight190.21 g/mol
Exact Mass190.09
IUPAC Name(3-methylimidazol-4-yl)-(2-methylpyrazol-3-yl)methanone
SMILESCn1cncc1C(=O)c1ccnn1C
InChIInChI=1S/C9H10N4O/c1-12-6-10-5-8(12)9(14)7-3-4-11-13(7)2/h3-6H,1-2H3
InChIKeyWROJDQPBZBIBDS-UHFFFAOYSA-N
XLogP0.38
TPSA52.71 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 50.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-methylimidazol-4-yl)-2-oxoacetic acid
CID 82416720
(2-methylpyrazol-3-yl)-pyrimidin-2-ylmethanone
CID 63960953
(1,5-dimethylpyrazol-4-yl)-(2-methylpyrazol-3-yl)methanone
CID 105100479
(2-methylpyrazol-3-yl)-(1,2,5-thiadiazol-3-yl)methanone
CID 105100351
1-(2-methylpyrazol-3-yl)ethanone;hydrobromide
CID 140678632
2-methyl-N'-(2-methylpyrazole-3-carbonyl)pyrazole-3-carbohydrazide
CID 899926
isoquinolin-4-yl-(2-methylpyrazol-3-yl)methanone
CID 105099533
(2-methylpyrazol-3-yl)-(2,4,6-trimethylphenyl)methanone
CID 114972636
imidazol-1-yl-(2-methylpyrazol-3-yl)methanone
CID 95927860
(2,5-difluorophenyl)-(3-methylimidazol-4-yl)methanone
CID 82895940
(2,4-dichlorophenyl)-(3-methylimidazol-4-yl)methanone
CID 71711489
(3-bromophenyl)-(3-methylimidazol-4-yl)methanone
CID 35580673

Frequently Asked Questions

What is the IUPAC name of (3-methylimidazol-4-yl)-(2-methylpyrazol-3-yl)methanone?
The IUPAC name of (3-methylimidazol-4-yl)-(2-methylpyrazol-3-yl)methanone (CID 82895472) is (3-methylimidazol-4-yl)-(2-methylpyrazol-3-yl)methanone.
What is the SMILES notation for (3-methylimidazol-4-yl)-(2-methylpyrazol-3-yl)methanone?
The canonical SMILES for (3-methylimidazol-4-yl)-(2-methylpyrazol-3-yl)methanone is Cn1cncc1C(=O)c1ccnn1C.
What is the InChIKey of (3-methylimidazol-4-yl)-(2-methylpyrazol-3-yl)methanone?
The InChIKey is WROJDQPBZBIBDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O/c1-12-6-10-5-8(12)9(14)7-3-4-11-13(7)2/h3-6H,1-2H3.
What are the key properties of (3-methylimidazol-4-yl)-(2-methylpyrazol-3-yl)methanone?
(3-methylimidazol-4-yl)-(2-methylpyrazol-3-yl)methanone has a molecular weight of 190.21 g/mol, XLogP of 0.38, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylimidazol-4-yl)-(2-methylpyrazol-3-yl)methanone is sourced from PubChem (CID 82895472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).