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

C12H18N6O — CID 102803199

IUPAC4-amino-N-(1,3-dimethylpyrazol-4-yl)-5-propyl-1H-pyrazole-3-carboxamide
SMILESCCCc1[nH]nc(C(=O)Nc2cn(C)nc2C)c1N
InChIInChI=1S/C12H18N6O/c1-4-5-8-10(13)11(16-15-8)12(19)14-9-6-18(3)17-7(9)2/h6H,4-5,13H2,1-3H3,(H,14,19)(H,15,16)
InChIKeyKXDCZKYWNODOCZ-UHFFFAOYSA-N
MW262.32 g/mol
LogP1.24
Rot. Bonds4

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

4-amino-N-(1,3-dimethylpyrazol-4-yl)-5-propyl-1H-pyrazole-3-carboxamide (PubChem CID 102803199) has the molecular formula C12H18N6O and a molecular weight of 262.32 g/mol. Its IUPAC name is 4-amino-N-(1,3-dimethylpyrazol-4-yl)-5-propyl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(1,3-dimethylpyrazol-4-yl)-5-propyl-1H-pyrazole-3-carboxamide
PubChem CID102803199
Molecular FormulaC12H18N6O
Molecular Weight262.32 g/mol
Exact Mass262.15
IUPAC Name4-amino-N-(1,3-dimethylpyrazol-4-yl)-5-propyl-1H-pyrazole-3-carboxamide
SMILESCCCc1[nH]nc(C(=O)Nc2cn(C)nc2C)c1N
InChIInChI=1S/C12H18N6O/c1-4-5-8-10(13)11(16-15-8)12(19)14-9-6-18(3)17-7(9)2/h6H,4-5,13H2,1-3H3,(H,14,19)(H,15,16)
InChIKeyKXDCZKYWNODOCZ-UHFFFAOYSA-N
XLogP1.24
TPSA101.62 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.32
LogP ≤ 51.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 4-amino-N-(1,3-dimethylpyrazol-4-yl)-5-propyl-1H-pyrazole-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-amino-N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 115988894
4-amino-N-(2-fluoro-5-methylphenyl)-5-propyl-1H-pyrazole-3-carboxamide
CID 62076748
4-amino-N-(3-fluoro-2-methylphenyl)-5-propyl-1H-pyrazole-3-carboxamide
CID 62077102
4-amino-5-propyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]-1H-pyrazole-3-carboxamide
CID 79223369
5-amino-N-(1,3-dimethylpyrazol-4-yl)-1H-indazole-3-carboxamide
CID 102803191
4-amino-N-(2,4-dichlorophenyl)-5-propyl-1H-pyrazole-3-carboxamide
CID 62075125
methyl 3-[(4-amino-5-propyl-1H-pyrazole-3-carbonyl)amino]thiophene-2-carboxylate
CID 62075771
3-amino-N-(1,3-dimethylpyrazol-4-yl)-5-methyl-1H-pyrazole-4-carboxamide
CID 102806908
4-amino-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 62076450
4-amino-N-tert-butyl-5-propyl-1H-pyrazole-3-carboxamide
CID 62075103
4-amino-N-(4-methylsulfanylphenyl)-5-propyl-1H-pyrazole-3-carboxamide
CID 62075447
4-amino-N-(4-fluoro-2-methoxyphenyl)-5-propyl-1H-pyrazole-3-carboxamide
CID 62077093

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1,3-dimethylpyrazol-4-yl)-5-propyl-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-(1,3-dimethylpyrazol-4-yl)-5-propyl-1H-pyrazole-3-carboxamide (CID 102803199) is 4-amino-N-(1,3-dimethylpyrazol-4-yl)-5-propyl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-(1,3-dimethylpyrazol-4-yl)-5-propyl-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-(1,3-dimethylpyrazol-4-yl)-5-propyl-1H-pyrazole-3-carboxamide is CCCc1[nH]nc(C(=O)Nc2cn(C)nc2C)c1N.
What is the InChIKey of 4-amino-N-(1,3-dimethylpyrazol-4-yl)-5-propyl-1H-pyrazole-3-carboxamide?
The InChIKey is KXDCZKYWNODOCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N6O/c1-4-5-8-10(13)11(16-15-8)12(19)14-9-6-18(3)17-7(9)2/h6H,4-5,13H2,1-3H3,(H,14,19)(H,15,16).
What are the key properties of 4-amino-N-(1,3-dimethylpyrazol-4-yl)-5-propyl-1H-pyrazole-3-carboxamide?
4-amino-N-(1,3-dimethylpyrazol-4-yl)-5-propyl-1H-pyrazole-3-carboxamide has a molecular weight of 262.32 g/mol, XLogP of 1.24, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1,3-dimethylpyrazol-4-yl)-5-propyl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 102803199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).