(2-methylpyrazol-3-yl)methyl imidazole-1-carboxylate

C9H10N4O2 — CID 134348473

IUPAC(2-methylpyrazol-3-yl)methyl imidazole-1-carboxylate
SMILESCn1nccc1COC(=O)n1ccnc1
InChIInChI=1S/C9H10N4O2/c1-12-8(2-3-11-12)6-15-9(14)13-5-4-10-7-13/h2-5,7H,6H2,1H3
InChIKeyREYKKXMCYNQWKL-UHFFFAOYSA-N
MW206.21 g/mol
LogP0.80
Rot. Bonds2

About (2-methylpyrazol-3-yl)methyl imidazole-1-carboxylate

(2-methylpyrazol-3-yl)methyl imidazole-1-carboxylate (PubChem CID 134348473) has the molecular formula C9H10N4O2 and a molecular weight of 206.21 g/mol. Its IUPAC name is (2-methylpyrazol-3-yl)methyl imidazole-1-carboxylate.

Molecular Properties

Compound Name(2-methylpyrazol-3-yl)methyl imidazole-1-carboxylate
PubChem CID134348473
Molecular FormulaC9H10N4O2
Molecular Weight206.21 g/mol
Exact Mass206.08
IUPAC Name(2-methylpyrazol-3-yl)methyl imidazole-1-carboxylate
SMILESCn1nccc1COC(=O)n1ccnc1
InChIInChI=1S/C9H10N4O2/c1-12-8(2-3-11-12)6-15-9(14)13-5-4-10-7-13/h2-5,7H,6H2,1H3
InChIKeyREYKKXMCYNQWKL-UHFFFAOYSA-N
XLogP0.80
TPSA61.94 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.21
LogP ≤ 50.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze (2-methylpyrazol-3-yl)methyl imidazole-1-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4-methoxyphenyl)methyl imidazole-1-carboxylate
CID 58630007
(2-methoxyphenyl)methyl imidazole-1-carboxylate
CID 170657703
imidazol-1-yl-(2-methylpyrazol-3-yl)methanone
CID 95927860
2-methoxyethyl imidazole-1-carboxylate
CID 10583275
1-benzofuran-2-ylmethyl imidazole-1-carboxylate
CID 142027707
2-phenylethyl imidazole-1-carboxylate
CID 15371420
(1-fluorosulfanyl-1,2,4-triazol-3-yl)methyl imidazole-1-carboxylate
CID 142433509
(4,5-dimethyl-2-nitrophenyl)methyl imidazole-1-carboxylate
CID 121346824
4,4,4-trifluorobutyl imidazole-1-carboxylate
CID 71419641
2-[(2-methylpyrazol-3-yl)methoxy]ethanol
CID 164538456
2-amino-N-[(2-methylpyrazol-3-yl)methyl]acetamide
CID 63302579
(2-methylpyrazol-3-yl)methyl 2,6-dichloro-5-fluoropyridine-3-carboxylate
CID 71911967

Frequently Asked Questions

What is the IUPAC name of (2-methylpyrazol-3-yl)methyl imidazole-1-carboxylate?
The IUPAC name of (2-methylpyrazol-3-yl)methyl imidazole-1-carboxylate (CID 134348473) is (2-methylpyrazol-3-yl)methyl imidazole-1-carboxylate.
What is the SMILES notation for (2-methylpyrazol-3-yl)methyl imidazole-1-carboxylate?
The canonical SMILES for (2-methylpyrazol-3-yl)methyl imidazole-1-carboxylate is Cn1nccc1COC(=O)n1ccnc1.
What is the InChIKey of (2-methylpyrazol-3-yl)methyl imidazole-1-carboxylate?
The InChIKey is REYKKXMCYNQWKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O2/c1-12-8(2-3-11-12)6-15-9(14)13-5-4-10-7-13/h2-5,7H,6H2,1H3.
What are the key properties of (2-methylpyrazol-3-yl)methyl imidazole-1-carboxylate?
(2-methylpyrazol-3-yl)methyl imidazole-1-carboxylate has a molecular weight of 206.21 g/mol, XLogP of 0.80, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpyrazol-3-yl)methyl imidazole-1-carboxylate is sourced from PubChem (CID 134348473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).