4-amino-N-(2-ethoxyphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide

C15H20N4O2 — CID 62077048

IUPAC4-amino-N-(2-ethoxyphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1n[nH]c(C(C)C)c1N
InChIInChI=1S/C15H20N4O2/c1-4-21-11-8-6-5-7-10(11)17-15(20)14-12(16)13(9(2)3)18-19-14/h5-9H,4,16H2,1-3H3,(H,17,20)(H,18,19)
InChIKeyLLFJWNPPSBATOY-UHFFFAOYSA-N
MW288.35 g/mol
LogP2.77
Rot. Bonds5

About 4-amino-N-(2-ethoxyphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide

4-amino-N-(2-ethoxyphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide (PubChem CID 62077048) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 4-amino-N-(2-ethoxyphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-ethoxyphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
PubChem CID62077048
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name4-amino-N-(2-ethoxyphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
SMILESCCOc1ccccc1NC(=O)c1n[nH]c(C(C)C)c1N
InChIInChI=1S/C15H20N4O2/c1-4-21-11-8-6-5-7-10(11)17-15(20)14-12(16)13(9(2)3)18-19-14/h5-9H,4,16H2,1-3H3,(H,17,20)(H,18,19)
InChIKeyLLFJWNPPSBATOY-UHFFFAOYSA-N
XLogP2.77
TPSA93.03 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 52.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(2-ethylphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 62077044
4-bromo-N-(2-butoxyphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 56566879
N-(2-ethoxyphenyl)-1H-indazole-3-carboxamide
CID 16866355
4-amino-N-[(2-methoxyphenyl)methyl]-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 62076883
4-amino-N-(2-ethoxyphenyl)-1H-pyrazole-5-carboxamide
CID 63105944
4-amino-5-methyl-N-(2-propan-2-ylphenyl)-1H-pyrazole-3-carboxamide
CID 62081566
N-(2-ethoxyphenyl)-3-hydroxypyridine-2-carboxamide
CID 54860891
(2S)-2-amino-N-(2-ethoxyphenyl)propanamide;hydrochloride
CID 119263916
(2S)-2-amino-N-(2-ethoxyphenyl)butanamide
CID 79025438
4-amino-N-(5-methyl-2-pyridinyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 62076548
4-amino-5-propan-2-yl-N-(2-propan-2-ylpyrazol-3-yl)-1H-pyrazole-3-carboxamide
CID 62077396
5-amino-1-(4-chlorophenyl)-N-(2-ethoxyphenyl)triazole-4-carboxamide
CID 6498251

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-ethoxyphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-(2-ethoxyphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide (CID 62077048) is 4-amino-N-(2-ethoxyphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-(2-ethoxyphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-(2-ethoxyphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide is CCOc1ccccc1NC(=O)c1n[nH]c(C(C)C)c1N.
What is the InChIKey of 4-amino-N-(2-ethoxyphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide?
The InChIKey is LLFJWNPPSBATOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-4-21-11-8-6-5-7-10(11)17-15(20)14-12(16)13(9(2)3)18-19-14/h5-9H,4,16H2,1-3H3,(H,17,20)(H,18,19).
What are the key properties of 4-amino-N-(2-ethoxyphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide?
4-amino-N-(2-ethoxyphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 2.77, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-ethoxyphenyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 62077048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).