3-(2-amino-2-oxoethoxy)-N-(1-benzylpyrazol-4-yl)benzamide

C19H18N4O3 — CID 134699731

IUPAC3-(2-amino-2-oxoethoxy)-N-(1-benzylpyrazol-4-yl)benzamide
SMILESNC(=O)COc1cccc(C(=O)Nc2cnn(Cc3ccccc3)c2)c1
InChIInChI=1S/C19H18N4O3/c20-18(24)13-26-17-8-4-7-15(9-17)19(25)22-16-10-21-23(12-16)11-14-5-2-1-3-6-14/h1-10,12H,11,13H2,(H2,20,24)(H,22,25)
InChIKeyFWGSAOMZABKGMR-UHFFFAOYSA-N
MW350.38 g/mol
LogP2.05
Rot. Bonds7

About 3-(2-amino-2-oxoethoxy)-N-(1-benzylpyrazol-4-yl)benzamide

3-(2-amino-2-oxoethoxy)-N-(1-benzylpyrazol-4-yl)benzamide (PubChem CID 134699731) has the molecular formula C19H18N4O3 and a molecular weight of 350.38 g/mol. Its IUPAC name is 3-(2-amino-2-oxoethoxy)-N-(1-benzylpyrazol-4-yl)benzamide.

Molecular Properties

Compound Name3-(2-amino-2-oxoethoxy)-N-(1-benzylpyrazol-4-yl)benzamide
PubChem CID134699731
Molecular FormulaC19H18N4O3
Molecular Weight350.38 g/mol
Exact Mass350.14
IUPAC Name3-(2-amino-2-oxoethoxy)-N-(1-benzylpyrazol-4-yl)benzamide
SMILESNC(=O)COc1cccc(C(=O)Nc2cnn(Cc3ccccc3)c2)c1
InChIInChI=1S/C19H18N4O3/c20-18(24)13-26-17-8-4-7-15(9-17)19(25)22-16-10-21-23(12-16)11-14-5-2-1-3-6-14/h1-10,12H,11,13H2,(H2,20,24)(H,22,25)
InChIKeyFWGSAOMZABKGMR-UHFFFAOYSA-N
XLogP2.05
TPSA99.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(4-bromophenoxy)methyl]-N-[1-[(4-bromophenyl)methyl]pyrazol-4-yl]benzamide
CID 19403863
3-(difluoromethoxy)-N-[1-[(3-methylphenyl)methyl]pyrazol-4-yl]benzamide
CID 19336243
N-(1-benzylpyrazol-4-yl)-6-chloropyridine-3-carboxamide
CID 60526938
3,5-diacetamido-N-(1-benzylpyrazol-4-yl)benzamide
CID 60552582
3-[(2-chlorophenoxy)methyl]-N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]benzamide
CID 19410119
3-[(3-chlorophenoxy)methyl]-N-[1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]benzamide
CID 19346774
N-(1-benzylpyrazol-4-yl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 60552845
N-(1-benzylpyrazol-4-yl)-1-ethylpyrazole-4-carboxamide
CID 19395795
N-[1-(2-amino-2-oxoethyl)pyrazol-4-yl]-3-pyridin-4-yloxybenzamide
CID 75371124
N-(1-benzylpyrazol-4-yl)-3-pyridin-2-yl-1,2-oxazole-5-carboxamide
CID 156596105
3-[(4-ethylphenoxy)methyl]-N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]benzamide
CID 19401679
N-(1-benzylpyrazol-4-yl)-4-(phenoxymethyl)thiophene-2-carboxamide
CID 19490888

Frequently Asked Questions

What is the IUPAC name of 3-(2-amino-2-oxoethoxy)-N-(1-benzylpyrazol-4-yl)benzamide?
The IUPAC name of 3-(2-amino-2-oxoethoxy)-N-(1-benzylpyrazol-4-yl)benzamide (CID 134699731) is 3-(2-amino-2-oxoethoxy)-N-(1-benzylpyrazol-4-yl)benzamide.
What is the SMILES notation for 3-(2-amino-2-oxoethoxy)-N-(1-benzylpyrazol-4-yl)benzamide?
The canonical SMILES for 3-(2-amino-2-oxoethoxy)-N-(1-benzylpyrazol-4-yl)benzamide is NC(=O)COc1cccc(C(=O)Nc2cnn(Cc3ccccc3)c2)c1.
What is the InChIKey of 3-(2-amino-2-oxoethoxy)-N-(1-benzylpyrazol-4-yl)benzamide?
The InChIKey is FWGSAOMZABKGMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O3/c20-18(24)13-26-17-8-4-7-15(9-17)19(25)22-16-10-21-23(12-16)11-14-5-2-1-3-6-14/h1-10,12H,11,13H2,(H2,20,24)(H,22,25).
What are the key properties of 3-(2-amino-2-oxoethoxy)-N-(1-benzylpyrazol-4-yl)benzamide?
3-(2-amino-2-oxoethoxy)-N-(1-benzylpyrazol-4-yl)benzamide has a molecular weight of 350.38 g/mol, XLogP of 2.05, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-amino-2-oxoethoxy)-N-(1-benzylpyrazol-4-yl)benzamide is sourced from PubChem (CID 134699731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).