2-(ethylamino)-2-(4-methoxyphenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide

C20H22N4O2 — CID 137425551

IUPAC2-(ethylamino)-2-(4-methoxyphenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide
SMILESCCNC(C(=O)Nc1ccc(-c2cn[nH]c2)cc1)c1ccc(OC)cc1
InChIInChI=1S/C20H22N4O2/c1-3-21-19(15-6-10-18(26-2)11-7-15)20(25)24-17-8-4-14(5-9-17)16-12-22-23-13-16/h4-13,19,21H,3H2,1-2H3,(H,22,23)(H,24,25)
InChIKeyCJQJNHRONARDRB-UHFFFAOYSA-N
MW350.42 g/mol
LogP3.37
Rot. Bonds7

About 2-(ethylamino)-2-(4-methoxyphenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide

2-(ethylamino)-2-(4-methoxyphenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide (PubChem CID 137425551) has the molecular formula C20H22N4O2 and a molecular weight of 350.42 g/mol. Its IUPAC name is 2-(ethylamino)-2-(4-methoxyphenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(ethylamino)-2-(4-methoxyphenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide
PubChem CID137425551
Molecular FormulaC20H22N4O2
Molecular Weight350.42 g/mol
Exact Mass350.17
IUPAC Name2-(ethylamino)-2-(4-methoxyphenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide
SMILESCCNC(C(=O)Nc1ccc(-c2cn[nH]c2)cc1)c1ccc(OC)cc1
InChIInChI=1S/C20H22N4O2/c1-3-21-19(15-6-10-18(26-2)11-7-15)20(25)24-17-8-4-14(5-9-17)16-12-22-23-13-16/h4-13,19,21H,3H2,1-2H3,(H,22,23)(H,24,25)
InChIKeyCJQJNHRONARDRB-UHFFFAOYSA-N
XLogP3.37
TPSA79.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 53.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(ethylamino)-2-(4-fluorophenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide
CID 137425585
2-(4-methoxyphenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]butanamide
CID 153113467
2-(3-methoxyphenyl)-2-(methylamino)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide
CID 137425440
3-amino-2-(4-fluorophenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]propanamide
CID 156562793
3-amino-2-[4-(hydroxymethyl)phenyl]-N-[4-(1H-pyrazol-4-yl)phenyl]propanamide
CID 156568971
1-[(2,4-dimethoxyphenyl)methyl]-3-[4-(1H-pyrazol-4-yl)phenyl]urea
CID 71654828
2-[3-(dimethylamino)phenyl]-N-[4-(1H-pyrazol-4-yl)phenyl]butanamide
CID 158988611
N-(4-methylphenyl)-4-(1H-pyrazol-4-yl)benzamide
CID 110464321
(2R)-2-hydroxy-N-(4-methoxyphenyl)butanamide
CID 139626636
ethyl 2-(4-methoxyanilino)-2-(4-methylphenyl)acetate
CID 102078700
(2R,3R)-N-(4-ethylphenyl)-3-hydroxy-3-(4-methoxyphenyl)-2-methylpropanamide
CID 96538151
N-(4-methoxyphenyl)-2-[5-(4-methoxyphenyl)-3-oxo-1,2,4-triazin-2-yl]butanamide
CID 51345697

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-2-(4-methoxyphenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide?
The IUPAC name of 2-(ethylamino)-2-(4-methoxyphenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide (CID 137425551) is 2-(ethylamino)-2-(4-methoxyphenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide.
What is the SMILES notation for 2-(ethylamino)-2-(4-methoxyphenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide?
The canonical SMILES for 2-(ethylamino)-2-(4-methoxyphenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide is CCNC(C(=O)Nc1ccc(-c2cn[nH]c2)cc1)c1ccc(OC)cc1.
What is the InChIKey of 2-(ethylamino)-2-(4-methoxyphenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide?
The InChIKey is CJQJNHRONARDRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2/c1-3-21-19(15-6-10-18(26-2)11-7-15)20(25)24-17-8-4-14(5-9-17)16-12-22-23-13-16/h4-13,19,21H,3H2,1-2H3,(H,22,23)(H,24,25).
What are the key properties of 2-(ethylamino)-2-(4-methoxyphenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide?
2-(ethylamino)-2-(4-methoxyphenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide has a molecular weight of 350.42 g/mol, XLogP of 3.37, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-2-(4-methoxyphenyl)-N-[4-(1H-pyrazol-4-yl)phenyl]acetamide is sourced from PubChem (CID 137425551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).