2-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)cyclopropane-1-carboxamide

C12H17N3O — CID 71860336

IUPAC2-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)cyclopropane-1-carboxamide
SMILESCc1cc(NC(=O)C2CC2C2CC2)n(C)n1
InChIInChI=1S/C12H17N3O/c1-7-5-11(15(2)14-7)13-12(16)10-6-9(10)8-3-4-8/h5,8-10H,3-4,6H2,1-2H3,(H,13,16)
InChIKeyFUMOJAYKEPXAJJ-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.71
Rot. Bonds3

About 2-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)cyclopropane-1-carboxamide

2-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)cyclopropane-1-carboxamide (PubChem CID 71860336) has the molecular formula C12H17N3O and a molecular weight of 219.29 g/mol. Its IUPAC name is 2-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)cyclopropane-1-carboxamide
PubChem CID71860336
Molecular FormulaC12H17N3O
Molecular Weight219.29 g/mol
Exact Mass219.14
IUPAC Name2-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)cyclopropane-1-carboxamide
SMILESCc1cc(NC(=O)C2CC2C2CC2)n(C)n1
InChIInChI=1S/C12H17N3O/c1-7-5-11(15(2)14-7)13-12(16)10-6-9(10)8-3-4-8/h5,8-10H,3-4,6H2,1-2H3,(H,13,16)
InChIKeyFUMOJAYKEPXAJJ-UHFFFAOYSA-N
XLogP1.71
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)cyclopropane-1-carboxamide?
The IUPAC name of 2-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)cyclopropane-1-carboxamide (CID 71860336) is 2-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for 2-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)cyclopropane-1-carboxamide?
The canonical SMILES for 2-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)cyclopropane-1-carboxamide is Cc1cc(NC(=O)C2CC2C2CC2)n(C)n1.
What is the InChIKey of 2-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)cyclopropane-1-carboxamide?
The InChIKey is FUMOJAYKEPXAJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O/c1-7-5-11(15(2)14-7)13-12(16)10-6-9(10)8-3-4-8/h5,8-10H,3-4,6H2,1-2H3,(H,13,16).
What are the key properties of 2-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)cyclopropane-1-carboxamide?
2-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)cyclopropane-1-carboxamide has a molecular weight of 219.29 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(2,5-dimethylpyrazol-3-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 71860336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).