5-amino-1-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyrazole-4-carboxamide

C15H20N4O — CID 82546319

IUPAC5-amino-1-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyrazole-4-carboxamide
SMILESCc1cccc(C(C)C)c1NC(=O)c1cnn(C)c1N
InChIInChI=1S/C15H20N4O/c1-9(2)11-7-5-6-10(3)13(11)18-15(20)12-8-17-19(4)14(12)16/h5-9H,16H2,1-4H3,(H,18,20)
InChIKeyLZTDXKAVYWTARI-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.69
Rot. Bonds3

About 5-amino-1-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyrazole-4-carboxamide

5-amino-1-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyrazole-4-carboxamide (PubChem CID 82546319) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 5-amino-1-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-1-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyrazole-4-carboxamide
PubChem CID82546319
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name5-amino-1-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyrazole-4-carboxamide
SMILESCc1cccc(C(C)C)c1NC(=O)c1cnn(C)c1N
InChIInChI=1S/C15H20N4O/c1-9(2)11-7-5-6-10(3)13(11)18-15(20)12-8-17-19(4)14(12)16/h5-9H,16H2,1-4H3,(H,18,20)
InChIKeyLZTDXKAVYWTARI-UHFFFAOYSA-N
XLogP2.69
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-1-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyrazole-5-carboxamide
CID 65356006
3-hydrazinyl-N-(2-methyl-6-propan-2-ylphenyl)pyridine-4-carboxamide
CID 105071522
5-amino-N-(3-hydroxyphenyl)-1-methylpyrazole-4-carboxamide
CID 82547033
4-amino-1-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyrazole-3-carboxamide
CID 65355014
5-methyl-N-(2-methyl-6-propan-2-ylphenyl)-1-quinolin-2-ylpyrazole-4-carboxamide
CID 108788845
N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 729062
6-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyridine-3-carboxamide
CID 18148418
2-N,5-N-bis(2-methyl-6-propan-2-ylphenyl)pyridine-2,5-dicarboxamide
CID 1312773
2-methyl-N-(2-methyl-6-propan-2-ylphenyl)-3-nitrobenzamide
CID 957054
5-hydrazinyl-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 107377417
5-amino-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1-methylpyrazole-4-carboxamide
CID 110452089
3-amino-N-(2-methyl-6-propan-2-ylphenyl)-3-sulfanylidenepropanamide
CID 28942450

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyrazole-4-carboxamide?
The IUPAC name of 5-amino-1-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyrazole-4-carboxamide (CID 82546319) is 5-amino-1-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-1-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyrazole-4-carboxamide?
The canonical SMILES for 5-amino-1-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyrazole-4-carboxamide is Cc1cccc(C(C)C)c1NC(=O)c1cnn(C)c1N.
What is the InChIKey of 5-amino-1-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyrazole-4-carboxamide?
The InChIKey is LZTDXKAVYWTARI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-9(2)11-7-5-6-10(3)13(11)18-15(20)12-8-17-19(4)14(12)16/h5-9H,16H2,1-4H3,(H,18,20).
What are the key properties of 5-amino-1-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyrazole-4-carboxamide?
5-amino-1-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyrazole-4-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 2.69, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-methyl-N-(2-methyl-6-propan-2-ylphenyl)pyrazole-4-carboxamide is sourced from PubChem (CID 82546319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).