5-amino-1-methyl-N-(2-phenylcyclopropyl)pyrazole-4-carboxamide

C14H16N4O — CID 115330669

IUPAC5-amino-1-methyl-N-(2-phenylcyclopropyl)pyrazole-4-carboxamide
SMILESCn1ncc(C(=O)NC2CC2c2ccccc2)c1N
InChIInChI=1S/C14H16N4O/c1-18-13(15)11(8-16-18)14(19)17-12-7-10(12)9-5-3-2-4-6-9/h2-6,8,10,12H,7,15H2,1H3,(H,17,19)
InChIKeyJWUMBXQMMOBLGK-UHFFFAOYSA-N
MW256.31 g/mol
LogP1.29
Rot. Bonds3

About 5-amino-1-methyl-N-(2-phenylcyclopropyl)pyrazole-4-carboxamide

5-amino-1-methyl-N-(2-phenylcyclopropyl)pyrazole-4-carboxamide (PubChem CID 115330669) has the molecular formula C14H16N4O and a molecular weight of 256.31 g/mol. Its IUPAC name is 5-amino-1-methyl-N-(2-phenylcyclopropyl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-1-methyl-N-(2-phenylcyclopropyl)pyrazole-4-carboxamide
PubChem CID115330669
Molecular FormulaC14H16N4O
Molecular Weight256.31 g/mol
Exact Mass256.13
IUPAC Name5-amino-1-methyl-N-(2-phenylcyclopropyl)pyrazole-4-carboxamide
SMILESCn1ncc(C(=O)NC2CC2c2ccccc2)c1N
InChIInChI=1S/C14H16N4O/c1-18-13(15)11(8-16-18)14(19)17-12-7-10(12)9-5-3-2-4-6-9/h2-6,8,10,12H,7,15H2,1H3,(H,17,19)
InChIKeyJWUMBXQMMOBLGK-UHFFFAOYSA-N
XLogP1.29
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-amino-N-(2,4-dimethylcyclohexyl)-1-methylpyrazole-4-carboxamide
CID 113288605
4-amino-1-ethyl-N-(2-phenylcyclopropyl)pyrazole-5-carboxamide
CID 65358906
5-amino-N-benzyl-1-methylpyrazole-4-carboxamide
CID 13174826
4-amino-3-ethyl-1-methyl-N-(2-phenylcyclopropyl)pyrazole-5-carboxamide
CID 66118023
5-amino-1-methyl-N-(3-methylcyclopentyl)pyrazole-4-carboxamide
CID 114549373
N-[(1S,2R)-2-phenylcyclopropyl]benzamide
CID 7350127
1-methyl-6-oxo-N-(2-phenylcyclopropyl)-4,5-dihydropyridazine-3-carboxamide
CID 75462215
3-amino-5-methyl-N-(2-phenylcyclopropyl)pyrazine-2-carboxamide
CID 10038673
1-methyl-N-(2-phenylcyclopropyl)pyrrole-2-carboxamide
CID 86768199
2-amino-3-chloro-N-(2-phenylcyclopropyl)benzamide
CID 115540566
6-hydrazinyl-N-(2-phenylcyclopropyl)pyridine-3-carboxamide
CID 62248555
N-[(1R,2R)-2-phenylcyclopropyl]acetamide
CID 6954168

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-methyl-N-(2-phenylcyclopropyl)pyrazole-4-carboxamide?
The IUPAC name of 5-amino-1-methyl-N-(2-phenylcyclopropyl)pyrazole-4-carboxamide (CID 115330669) is 5-amino-1-methyl-N-(2-phenylcyclopropyl)pyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-1-methyl-N-(2-phenylcyclopropyl)pyrazole-4-carboxamide?
The canonical SMILES for 5-amino-1-methyl-N-(2-phenylcyclopropyl)pyrazole-4-carboxamide is Cn1ncc(C(=O)NC2CC2c2ccccc2)c1N.
What is the InChIKey of 5-amino-1-methyl-N-(2-phenylcyclopropyl)pyrazole-4-carboxamide?
The InChIKey is JWUMBXQMMOBLGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O/c1-18-13(15)11(8-16-18)14(19)17-12-7-10(12)9-5-3-2-4-6-9/h2-6,8,10,12H,7,15H2,1H3,(H,17,19).
What are the key properties of 5-amino-1-methyl-N-(2-phenylcyclopropyl)pyrazole-4-carboxamide?
5-amino-1-methyl-N-(2-phenylcyclopropyl)pyrazole-4-carboxamide has a molecular weight of 256.31 g/mol, XLogP of 1.29, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-methyl-N-(2-phenylcyclopropyl)pyrazole-4-carboxamide is sourced from PubChem (CID 115330669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).