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

C15H20N4O — CID 62080944

IUPAC4-amino-5-ethyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-3-carboxamide
SMILESCCc1[nH]nc(C(=O)NC(C)c2ccc(C)cc2)c1N
InChIInChI=1S/C15H20N4O/c1-4-12-13(16)14(19-18-12)15(20)17-10(3)11-7-5-9(2)6-8-11/h5-8,10H,4,16H2,1-3H3,(H,17,20)(H,18,19)
InChIKeyOKIYWOSWGYKSHK-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.35
Rot. Bonds4

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

4-amino-5-ethyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-3-carboxamide (PubChem CID 62080944) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 4-amino-5-ethyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-5-ethyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-3-carboxamide
PubChem CID62080944
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name4-amino-5-ethyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-3-carboxamide
SMILESCCc1[nH]nc(C(=O)NC(C)c2ccc(C)cc2)c1N
InChIInChI=1S/C15H20N4O/c1-4-12-13(16)14(19-18-12)15(20)17-10(3)11-7-5-9(2)6-8-11/h5-8,10H,4,16H2,1-3H3,(H,17,20)(H,18,19)
InChIKeyOKIYWOSWGYKSHK-UHFFFAOYSA-N
XLogP2.35
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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4-amino-5-propyl-N-(1-pyridin-4-ylethyl)-1H-pyrazole-3-carboxamide
CID 62076755
4-amino-5-ethyl-N-(3-methylpentan-2-yl)-1H-pyrazole-3-carboxamide
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CID 62081467
4-amino-5-ethyl-N-[(2S)-1-hydroxypropan-2-yl]-1H-pyrazole-3-carboxamide
CID 107210470
4-amino-5-propyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrazole-3-carboxamide
CID 106208024
4-amino-5-ethyl-N-(4-propan-2-ylphenyl)-1H-pyrazole-3-carboxamide
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4-amino-N-[(1R)-1-(4-bromophenyl)ethyl]-5-methyl-1H-pyrazole-3-carboxamide
CID 107868791
4-amino-5-ethyl-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-1H-pyrazole-3-carboxamide
CID 79248265
4-amino-N-(2,5-dimethylphenyl)-5-ethyl-1H-pyrazole-3-carboxamide
CID 62080747
4-amino-5-ethyl-N-hexan-3-yl-1H-pyrazole-3-carboxamide
CID 62092746

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-ethyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-5-ethyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-3-carboxamide (CID 62080944) is 4-amino-5-ethyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-5-ethyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-5-ethyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-3-carboxamide is CCc1[nH]nc(C(=O)NC(C)c2ccc(C)cc2)c1N.
What is the InChIKey of 4-amino-5-ethyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-3-carboxamide?
The InChIKey is OKIYWOSWGYKSHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-4-12-13(16)14(19-18-12)15(20)17-10(3)11-7-5-9(2)6-8-11/h5-8,10H,4,16H2,1-3H3,(H,17,20)(H,18,19).
What are the key properties of 4-amino-5-ethyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-3-carboxamide?
4-amino-5-ethyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-3-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 2.35, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-ethyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 62080944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).