N-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazole-4-carboxamide

C10H13N5O — CID 62904126

IUPACN-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazole-4-carboxamide
SMILESCC(C)n1cc(NC(=O)c2cn[nH]c2)cn1
InChIInChI=1S/C10H13N5O/c1-7(2)15-6-9(5-13-15)14-10(16)8-3-11-12-4-8/h3-7H,1-2H3,(H,11,12)(H,14,16)
InChIKeyZSSFKTHFFLVDMT-UHFFFAOYSA-N
MW219.25 g/mol
LogP1.44
Rot. Bonds3

About N-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazole-4-carboxamide

N-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazole-4-carboxamide (PubChem CID 62904126) has the molecular formula C10H13N5O and a molecular weight of 219.25 g/mol. Its IUPAC name is N-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazole-4-carboxamide
PubChem CID62904126
Molecular FormulaC10H13N5O
Molecular Weight219.25 g/mol
Exact Mass219.11
IUPAC NameN-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazole-4-carboxamide
SMILESCC(C)n1cc(NC(=O)c2cn[nH]c2)cn1
InChIInChI=1S/C10H13N5O/c1-7(2)15-6-9(5-13-15)14-10(16)8-3-11-12-4-8/h3-7H,1-2H3,(H,11,12)(H,14,16)
InChIKeyZSSFKTHFFLVDMT-UHFFFAOYSA-N
XLogP1.44
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.25
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-oxo-N-(1-propan-2-ylpyrazol-4-yl)-1H-pyridine-3-carboxamide
CID 62904281
3-propan-2-yloxy-N-(1-propan-2-ylpyrazol-4-yl)benzamide
CID 134702922
6-bromo-N-(1-propan-2-ylpyrazol-4-yl)pyridine-3-carboxamide
CID 66462563
N-(1-propan-2-ylpyrazol-4-yl)-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide
CID 71267344
2-[4-(1H-pyrazole-4-carbonylamino)pyrazol-1-yl]acetic acid
CID 61019180
N-(1-propan-2-ylpyrazol-4-yl)-5-(1H-pyrazol-4-yl)-3H-isoindole-1-carboxamide
CID 160764072
2,2-dimethyl-N-(1-propan-2-ylpyrazol-4-yl)propanamide
CID 62999988
N-(1-propan-2-ylpyrazol-4-yl)but-2-enamide
CID 78920031
N-[4-[1-(methylamino)ethyl]phenyl]-1H-pyrazole-4-carboxamide
CID 63085076
4-amino-1-methyl-N-(1-propan-2-ylpyrazol-4-yl)pyrazole-5-carboxamide
CID 65360004
N-propan-2-yl-1H-pyrazole-4-carboxamide
CID 20785130
N-(1-propan-2-ylpyrazol-4-yl)-6-(propylamino)pyridine-3-carboxamide
CID 62903269

Frequently Asked Questions

What is the IUPAC name of N-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazole-4-carboxamide?
The IUPAC name of N-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazole-4-carboxamide (CID 62904126) is N-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for N-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazole-4-carboxamide is CC(C)n1cc(NC(=O)c2cn[nH]c2)cn1.
What is the InChIKey of N-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazole-4-carboxamide?
The InChIKey is ZSSFKTHFFLVDMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O/c1-7(2)15-6-9(5-13-15)14-10(16)8-3-11-12-4-8/h3-7H,1-2H3,(H,11,12)(H,14,16).
What are the key properties of N-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazole-4-carboxamide?
N-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazole-4-carboxamide has a molecular weight of 219.25 g/mol, XLogP of 1.44, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-propan-2-ylpyrazol-4-yl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 62904126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).