4-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrazole-5-carboxamide

C11H16N6O — CID 104616173

IUPAC4-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrazole-5-carboxamide
SMILESCCCc1cc(NC(=O)c2c(N)cnn2C)n[nH]1
InChIInChI=1S/C11H16N6O/c1-3-4-7-5-9(16-15-7)14-11(18)10-8(12)6-13-17(10)2/h5-6H,3-4,12H2,1-2H3,(H2,14,15,16,18)
InChIKeyDCPYLXXXDNXWRZ-UHFFFAOYSA-N
MW248.29 g/mol
LogP0.93
Rot. Bonds4

About 4-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrazole-5-carboxamide

4-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrazole-5-carboxamide (PubChem CID 104616173) has the molecular formula C11H16N6O and a molecular weight of 248.29 g/mol. Its IUPAC name is 4-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrazole-5-carboxamide
PubChem CID104616173
Molecular FormulaC11H16N6O
Molecular Weight248.29 g/mol
Exact Mass248.14
IUPAC Name4-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrazole-5-carboxamide
SMILESCCCc1cc(NC(=O)c2c(N)cnn2C)n[nH]1
InChIInChI=1S/C11H16N6O/c1-3-4-7-5-9(16-15-7)14-11(18)10-8(12)6-13-17(10)2/h5-6H,3-4,12H2,1-2H3,(H2,14,15,16,18)
InChIKeyDCPYLXXXDNXWRZ-UHFFFAOYSA-N
XLogP0.93
TPSA101.62 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.29
LogP ≤ 50.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-(azetidine-1-carbonyl)-N-(5-butyl-1-cyclopentylpyrazol-3-yl)-1-methylpyrazole-5-carboxamide
CID 165415316
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CID 165415332
4-(azetidine-1-carbonyl)-N-(5-cyclohexyl-1H-pyrazol-3-yl)-1-methylpyrazole-5-carboxamide
CID 165415338
4-(azetidine-1-carbonyl)-N-(5-cyclopropyl-1-ethylpyrazol-3-yl)-1-methylpyrazole-5-carboxamide
CID 165415444
4-(azetidine-1-carbonyl)-1-methyl-N-(5-propan-2-yl-1H-pyrazol-3-yl)pyrazole-5-carboxamide
CID 165415400
4-(azetidine-1-carbonyl)-N-(5-cyclobutyl-1H-pyrazol-3-yl)-1-methylpyrazole-5-carboxamide
CID 165415408
N-(5-ethyl-4-methyl-1H-pyrazol-3-yl)-1H-pyrazole-5-carboxamide
CID 71854577
1-methyl-5-(2-methylpyrazol-3-yl)-3-propyl-6H-pyrazolo[4,5-d]pyrimidin-7-one
CID 136240290
5-cyclopropyl-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-3-carboxamide
CID 36132041
N-(2,5-dimethylpyrazol-3-yl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 47283794
5-cyclopropyl-N-[2-(cyclopropylmethyl)pyrazol-3-yl]-1H-pyrazole-3-carboxamide
CID 71848104
N-[5-[(2S)-pentan-2-yl]-1H-pyrazol-3-yl]-1H-pyrazole-5-carboxamide
CID 96110121

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrazole-5-carboxamide?
The IUPAC name of 4-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrazole-5-carboxamide (CID 104616173) is 4-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrazole-5-carboxamide?
The canonical SMILES for 4-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrazole-5-carboxamide is CCCc1cc(NC(=O)c2c(N)cnn2C)n[nH]1.
What is the InChIKey of 4-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrazole-5-carboxamide?
The InChIKey is DCPYLXXXDNXWRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N6O/c1-3-4-7-5-9(16-15-7)14-11(18)10-8(12)6-13-17(10)2/h5-6H,3-4,12H2,1-2H3,(H2,14,15,16,18).
What are the key properties of 4-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrazole-5-carboxamide?
4-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrazole-5-carboxamide has a molecular weight of 248.29 g/mol, XLogP of 0.93, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrazole-5-carboxamide is sourced from PubChem (CID 104616173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).