1-(5-cyclopropyl-1H-pyrazol-3-yl)imidazole-4,5-dicarboxamide

C11H12N6O2 — CID 66623034

IUPAC1-(5-cyclopropyl-1H-pyrazol-3-yl)imidazole-4,5-dicarboxamide
SMILESNC(=O)c1ncn(-c2cc(C3CC3)[nH]n2)c1C(N)=O
InChIInChI=1S/C11H12N6O2/c12-10(18)8-9(11(13)19)17(4-14-8)7-3-6(15-16-7)5-1-2-5/h3-5H,1-2H2,(H2,12,18)(H2,13,19)(H,15,16)
InChIKeyWRCCVLCLCHQIKC-UHFFFAOYSA-N
MW260.26 g/mol
LogP-0.33
Rot. Bonds4

About 1-(5-cyclopropyl-1H-pyrazol-3-yl)imidazole-4,5-dicarboxamide

1-(5-cyclopropyl-1H-pyrazol-3-yl)imidazole-4,5-dicarboxamide (PubChem CID 66623034) has the molecular formula C11H12N6O2 and a molecular weight of 260.26 g/mol. Its IUPAC name is 1-(5-cyclopropyl-1H-pyrazol-3-yl)imidazole-4,5-dicarboxamide.

Molecular Properties

Compound Name1-(5-cyclopropyl-1H-pyrazol-3-yl)imidazole-4,5-dicarboxamide
PubChem CID66623034
Molecular FormulaC11H12N6O2
Molecular Weight260.26 g/mol
Exact Mass260.10
IUPAC Name1-(5-cyclopropyl-1H-pyrazol-3-yl)imidazole-4,5-dicarboxamide
SMILESNC(=O)c1ncn(-c2cc(C3CC3)[nH]n2)c1C(N)=O
InChIInChI=1S/C11H12N6O2/c12-10(18)8-9(11(13)19)17(4-14-8)7-3-6(15-16-7)5-1-2-5/h3-5H,1-2H2,(H2,12,18)(H2,13,19)(H,15,16)
InChIKeyWRCCVLCLCHQIKC-UHFFFAOYSA-N
XLogP-0.33
TPSA132.68 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.26
LogP ≤ 5-0.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

1-(5-cyclopropyl-1H-pyrazol-3-yl)piperidin-4-amine
CID 91811818
3-(2-chloropyrrol-1-yl)-5-cyclopropyl-1H-pyrazole
CID 141198855
3-amino-3-(5-cyclopropyl-1H-pyrazol-3-yl)propanoic acid
CID 83830941
1-(5-cyclopropyl-1H-pyrazol-3-yl)-1-ethylurea
CID 174442006
3-(5-cyclopropyl-1H-pyrazol-3-yl)-N-[(4-fluorophenyl)methyl]benzimidazol-5-amine
CID 11996234
5-[(3R)-piperidin-3-yl]-1H-pyrazole-3-carboxamide
CID 92615149
(4-chlorophenyl)-[1-(5-cyclopropyl-1H-pyrazol-3-yl)pyrrol-3-yl]methanone
CID 175238918
3-(3-carbamoyl-1H-pyrazol-5-yl)-N-propan-2-ylpiperidine-1-carboxamide
CID 75378433
1-(5-cyclopropyl-1H-pyrazol-3-yl)-2-(methylamino)ethanone
CID 83828020
(5-cyclopropyl-1H-pyrazol-3-yl)-[(2S,5R)-2,5-dimethylmorpholin-4-yl]methanone
CID 94051637
(2-oxo-2-piperidin-1-ylethyl) 5-cyclopropyl-1H-pyrazole-3-carboxylate
CID 55569703
5-piperidin-4-yl-1H-pyrazole-3-carboxylic acid
CID 83409074

Frequently Asked Questions

What is the IUPAC name of 1-(5-cyclopropyl-1H-pyrazol-3-yl)imidazole-4,5-dicarboxamide?
The IUPAC name of 1-(5-cyclopropyl-1H-pyrazol-3-yl)imidazole-4,5-dicarboxamide (CID 66623034) is 1-(5-cyclopropyl-1H-pyrazol-3-yl)imidazole-4,5-dicarboxamide.
What is the SMILES notation for 1-(5-cyclopropyl-1H-pyrazol-3-yl)imidazole-4,5-dicarboxamide?
The canonical SMILES for 1-(5-cyclopropyl-1H-pyrazol-3-yl)imidazole-4,5-dicarboxamide is NC(=O)c1ncn(-c2cc(C3CC3)[nH]n2)c1C(N)=O.
What is the InChIKey of 1-(5-cyclopropyl-1H-pyrazol-3-yl)imidazole-4,5-dicarboxamide?
The InChIKey is WRCCVLCLCHQIKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N6O2/c12-10(18)8-9(11(13)19)17(4-14-8)7-3-6(15-16-7)5-1-2-5/h3-5H,1-2H2,(H2,12,18)(H2,13,19)(H,15,16).
What are the key properties of 1-(5-cyclopropyl-1H-pyrazol-3-yl)imidazole-4,5-dicarboxamide?
1-(5-cyclopropyl-1H-pyrazol-3-yl)imidazole-4,5-dicarboxamide has a molecular weight of 260.26 g/mol, XLogP of -0.33, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-cyclopropyl-1H-pyrazol-3-yl)imidazole-4,5-dicarboxamide is sourced from PubChem (CID 66623034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).