4-amino-N-[3-(dimethylamino)-4-methylphenyl]-5-ethyl-1H-pyrazole-3-carboxamide

C15H21N5O — CID 115375786

IUPAC4-amino-N-[3-(dimethylamino)-4-methylphenyl]-5-ethyl-1H-pyrazole-3-carboxamide
SMILESCCc1[nH]nc(C(=O)Nc2ccc(C)c(N(C)C)c2)c1N
InChIInChI=1S/C15H21N5O/c1-5-11-13(16)14(19-18-11)15(21)17-10-7-6-9(2)12(8-10)20(3)4/h6-8H,5,16H2,1-4H3,(H,17,21)(H,18,19)
InChIKeyGQEZNGGDTNZDKF-UHFFFAOYSA-N
MW287.37 g/mol
LogP2.18
Rot. Bonds4

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

4-amino-N-[3-(dimethylamino)-4-methylphenyl]-5-ethyl-1H-pyrazole-3-carboxamide (PubChem CID 115375786) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 4-amino-N-[3-(dimethylamino)-4-methylphenyl]-5-ethyl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-[3-(dimethylamino)-4-methylphenyl]-5-ethyl-1H-pyrazole-3-carboxamide
PubChem CID115375786
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name4-amino-N-[3-(dimethylamino)-4-methylphenyl]-5-ethyl-1H-pyrazole-3-carboxamide
SMILESCCc1[nH]nc(C(=O)Nc2ccc(C)c(N(C)C)c2)c1N
InChIInChI=1S/C15H21N5O/c1-5-11-13(16)14(19-18-11)15(21)17-10-7-6-9(2)12(8-10)20(3)4/h6-8H,5,16H2,1-4H3,(H,17,21)(H,18,19)
InChIKeyGQEZNGGDTNZDKF-UHFFFAOYSA-N
XLogP2.18
TPSA87.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 52.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(3,5-dimethylphenyl)-5-ethyl-1H-pyrazole-3-carboxamide
CID 62082853
4-amino-N-(2,5-dimethylphenyl)-5-ethyl-1H-pyrazole-3-carboxamide
CID 62080747
4-amino-5-ethyl-N-(4-propan-2-ylphenyl)-1H-pyrazole-3-carboxamide
CID 62082857
4-amino-5-ethyl-N-(3-fluoro-5-methylphenyl)-1H-pyrazole-3-carboxamide
CID 79048461
4-amino-5-ethyl-N-(3-methyl-4-pyridinyl)-1H-pyrazole-3-carboxamide
CID 63669329
4-amino-N-[3-(dimethylamino)-4-methylphenyl]-1,3-dimethylpyrazole-5-carboxamide
CID 115375824
4-amino-5-ethyl-N-(1-ethylpyrazol-4-yl)-1H-pyrazole-3-carboxamide
CID 62082337
2,4-diamino-N-[3-(dimethylamino)-4-methylphenyl]benzamide
CID 115375793
4-amino-N-(3-hydroxy-4-methylphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 107699370
4-amino-N-[3-(dimethylamino)-4-methylphenyl]-5-methylthiophene-2-carboxamide
CID 115375794
4-amino-N-(4-methylsulfanylphenyl)-5-propyl-1H-pyrazole-3-carboxamide
CID 62075447
4-amino-5-ethyl-N-(4-methoxy-6-methylpyrimidin-2-yl)-1H-pyrazole-3-carboxamide
CID 107605336

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[3-(dimethylamino)-4-methylphenyl]-5-ethyl-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-[3-(dimethylamino)-4-methylphenyl]-5-ethyl-1H-pyrazole-3-carboxamide (CID 115375786) is 4-amino-N-[3-(dimethylamino)-4-methylphenyl]-5-ethyl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-[3-(dimethylamino)-4-methylphenyl]-5-ethyl-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-[3-(dimethylamino)-4-methylphenyl]-5-ethyl-1H-pyrazole-3-carboxamide is CCc1[nH]nc(C(=O)Nc2ccc(C)c(N(C)C)c2)c1N.
What is the InChIKey of 4-amino-N-[3-(dimethylamino)-4-methylphenyl]-5-ethyl-1H-pyrazole-3-carboxamide?
The InChIKey is GQEZNGGDTNZDKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-5-11-13(16)14(19-18-11)15(21)17-10-7-6-9(2)12(8-10)20(3)4/h6-8H,5,16H2,1-4H3,(H,17,21)(H,18,19).
What are the key properties of 4-amino-N-[3-(dimethylamino)-4-methylphenyl]-5-ethyl-1H-pyrazole-3-carboxamide?
4-amino-N-[3-(dimethylamino)-4-methylphenyl]-5-ethyl-1H-pyrazole-3-carboxamide has a molecular weight of 287.37 g/mol, XLogP of 2.18, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[3-(dimethylamino)-4-methylphenyl]-5-ethyl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 115375786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).