4-amino-5-cyclopropyl-N-[4-(dimethylamino)phenyl]-1H-pyrazole-3-carboxamide

C15H19N5O — CID 62078614

IUPAC4-amino-5-cyclopropyl-N-[4-(dimethylamino)phenyl]-1H-pyrazole-3-carboxamide
SMILESCN(C)c1ccc(NC(=O)c2n[nH]c(C3CC3)c2N)cc1
InChIInChI=1S/C15H19N5O/c1-20(2)11-7-5-10(6-8-11)17-15(21)14-12(16)13(18-19-14)9-3-4-9/h5-9H,3-4,16H2,1-2H3,(H,17,21)(H,18,19)
InChIKeyHCOXZXPQTYHBAX-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.19
Rot. Bonds4

About 4-amino-5-cyclopropyl-N-[4-(dimethylamino)phenyl]-1H-pyrazole-3-carboxamide

4-amino-5-cyclopropyl-N-[4-(dimethylamino)phenyl]-1H-pyrazole-3-carboxamide (PubChem CID 62078614) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is 4-amino-5-cyclopropyl-N-[4-(dimethylamino)phenyl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-5-cyclopropyl-N-[4-(dimethylamino)phenyl]-1H-pyrazole-3-carboxamide
PubChem CID62078614
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC Name4-amino-5-cyclopropyl-N-[4-(dimethylamino)phenyl]-1H-pyrazole-3-carboxamide
SMILESCN(C)c1ccc(NC(=O)c2n[nH]c(C3CC3)c2N)cc1
InChIInChI=1S/C15H19N5O/c1-20(2)11-7-5-10(6-8-11)17-15(21)14-12(16)13(18-19-14)9-3-4-9/h5-9H,3-4,16H2,1-2H3,(H,17,21)(H,18,19)
InChIKeyHCOXZXPQTYHBAX-UHFFFAOYSA-N
XLogP2.19
TPSA87.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

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CID 62077284
4-amino-5-cyclopropyl-N-(3-propan-2-ylphenyl)-1H-pyrazole-3-carboxamide
CID 62077622
4-amino-N-(3-chloro-4-cyanophenyl)-5-cyclopropyl-1H-pyrazole-3-carboxamide
CID 62077623
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CID 65467132
4-amino-5-cyclopropyl-N-(2-methylpyrazol-3-yl)-1H-pyrazole-3-carboxamide
CID 62079918
4-amino-5-cyclopropyl-N-(2,5-dichlorophenyl)-1H-pyrazole-3-carboxamide
CID 62075479
4-amino-N-(2-chloropyrimidin-4-yl)-5-cyclopropyl-1H-pyrazole-3-carboxamide
CID 116794674
4-amino-5-cyclopropyl-N-[2-(dimethylsulfamoyl)ethyl]-1H-pyrazole-3-carboxamide
CID 106333015
4-amino-5-cyclopropyl-N-[(1R)-1-phenylethyl]-1H-pyrazole-3-carboxamide
CID 107863851
4-amino-5-cyclopropyl-N-(2-methylcyclopropyl)-1H-pyrazole-3-carboxamide
CID 62396873
4-amino-5-cyclopropyl-N-[2-[di(propan-2-yl)amino]ethyl]-1H-pyrazole-3-carboxamide
CID 62077444

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-cyclopropyl-N-[4-(dimethylamino)phenyl]-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-5-cyclopropyl-N-[4-(dimethylamino)phenyl]-1H-pyrazole-3-carboxamide (CID 62078614) is 4-amino-5-cyclopropyl-N-[4-(dimethylamino)phenyl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-5-cyclopropyl-N-[4-(dimethylamino)phenyl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-5-cyclopropyl-N-[4-(dimethylamino)phenyl]-1H-pyrazole-3-carboxamide is CN(C)c1ccc(NC(=O)c2n[nH]c(C3CC3)c2N)cc1.
What is the InChIKey of 4-amino-5-cyclopropyl-N-[4-(dimethylamino)phenyl]-1H-pyrazole-3-carboxamide?
The InChIKey is HCOXZXPQTYHBAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c1-20(2)11-7-5-10(6-8-11)17-15(21)14-12(16)13(18-19-14)9-3-4-9/h5-9H,3-4,16H2,1-2H3,(H,17,21)(H,18,19).
What are the key properties of 4-amino-5-cyclopropyl-N-[4-(dimethylamino)phenyl]-1H-pyrazole-3-carboxamide?
4-amino-5-cyclopropyl-N-[4-(dimethylamino)phenyl]-1H-pyrazole-3-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 2.19, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-cyclopropyl-N-[4-(dimethylamino)phenyl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 62078614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).