3-amino-N-(1,3-dimethylpyrazol-4-yl)-5-methyl-1H-pyrazole-4-carboxamide

C10H14N6O — CID 102806908

IUPAC3-amino-N-(1,3-dimethylpyrazol-4-yl)-5-methyl-1H-pyrazole-4-carboxamide
SMILESCc1nn(C)cc1NC(=O)c1c(N)n[nH]c1C
InChIInChI=1S/C10H14N6O/c1-5-7(4-16(3)15-5)12-10(17)8-6(2)13-14-9(8)11/h4H,1-3H3,(H,12,17)(H3,11,13,14)
InChIKeyGJZUKLIYFHAPHZ-UHFFFAOYSA-N
MW234.26 g/mol
LogP0.59
Rot. Bonds2

About 3-amino-N-(1,3-dimethylpyrazol-4-yl)-5-methyl-1H-pyrazole-4-carboxamide

3-amino-N-(1,3-dimethylpyrazol-4-yl)-5-methyl-1H-pyrazole-4-carboxamide (PubChem CID 102806908) has the molecular formula C10H14N6O and a molecular weight of 234.26 g/mol. Its IUPAC name is 3-amino-N-(1,3-dimethylpyrazol-4-yl)-5-methyl-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name3-amino-N-(1,3-dimethylpyrazol-4-yl)-5-methyl-1H-pyrazole-4-carboxamide
PubChem CID102806908
Molecular FormulaC10H14N6O
Molecular Weight234.26 g/mol
Exact Mass234.12
IUPAC Name3-amino-N-(1,3-dimethylpyrazol-4-yl)-5-methyl-1H-pyrazole-4-carboxamide
SMILESCc1nn(C)cc1NC(=O)c1c(N)n[nH]c1C
InChIInChI=1S/C10H14N6O/c1-5-7(4-16(3)15-5)12-10(17)8-6(2)13-14-9(8)11/h4H,1-3H3,(H,12,17)(H3,11,13,14)
InChIKeyGJZUKLIYFHAPHZ-UHFFFAOYSA-N
XLogP0.59
TPSA101.62 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 50.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(1,3-dimethylpyrazol-4-yl)carbamoyl]-3,6-dimethylbenzoic acid
CID 103429481
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CID 102807672
5-amino-N-(1,3-dimethylpyrazol-4-yl)-1H-indazole-3-carboxamide
CID 102803191
4-amino-N-(1,3-dimethylpyrazol-4-yl)-5-propyl-1H-pyrazole-3-carboxamide
CID 102803199
2-amino-N-(1,3-dimethylpyrazol-4-yl)-4-methyl-1,3-thiazole-5-carboxamide
CID 104872498
3-amino-5-methyl-N-(2,3,4,5,6-pentafluorophenyl)-1H-pyrazole-4-carboxamide
CID 115564788
N-(1,3-dimethylpyrazol-4-yl)-2-hydrazinyl-2-oxoacetamide
CID 102806911
4-amino-N-(1,3-dimethylpyrazol-4-yl)-6-methylpyridine-3-carboxamide
CID 102807226
3-amino-N-(1,3-dimethylpyrazol-4-yl)pyridine-4-carboxamide
CID 102807250
4-amino-N-(1,3-dimethylpyrazol-4-yl)-3-ethyl-1-methylpyrazole-5-carboxamide
CID 102803235
4-amino-3-chloro-N-(1,3-dimethylpyrazol-4-yl)benzamide
CID 102803289
4-(aminomethyl)-N-(1,3-dimethylpyrazol-4-yl)benzamide
CID 103796977

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1,3-dimethylpyrazol-4-yl)-5-methyl-1H-pyrazole-4-carboxamide?
The IUPAC name of 3-amino-N-(1,3-dimethylpyrazol-4-yl)-5-methyl-1H-pyrazole-4-carboxamide (CID 102806908) is 3-amino-N-(1,3-dimethylpyrazol-4-yl)-5-methyl-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 3-amino-N-(1,3-dimethylpyrazol-4-yl)-5-methyl-1H-pyrazole-4-carboxamide?
The canonical SMILES for 3-amino-N-(1,3-dimethylpyrazol-4-yl)-5-methyl-1H-pyrazole-4-carboxamide is Cc1nn(C)cc1NC(=O)c1c(N)n[nH]c1C.
What is the InChIKey of 3-amino-N-(1,3-dimethylpyrazol-4-yl)-5-methyl-1H-pyrazole-4-carboxamide?
The InChIKey is GJZUKLIYFHAPHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6O/c1-5-7(4-16(3)15-5)12-10(17)8-6(2)13-14-9(8)11/h4H,1-3H3,(H,12,17)(H3,11,13,14).
What are the key properties of 3-amino-N-(1,3-dimethylpyrazol-4-yl)-5-methyl-1H-pyrazole-4-carboxamide?
3-amino-N-(1,3-dimethylpyrazol-4-yl)-5-methyl-1H-pyrazole-4-carboxamide has a molecular weight of 234.26 g/mol, XLogP of 0.59, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1,3-dimethylpyrazol-4-yl)-5-methyl-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 102806908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).