N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(2-methoxyacetyl)amino]benzamide

C15H18N4O3 — CID 21369133

IUPACN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(2-methoxyacetyl)amino]benzamide
SMILESCOCC(=O)Nc1ccccc1C(=O)Nc1c(C)n[nH]c1C
InChIInChI=1S/C15H18N4O3/c1-9-14(10(2)19-18-9)17-15(21)11-6-4-5-7-12(11)16-13(20)8-22-3/h4-7H,8H2,1-3H3,(H,16,20)(H,17,21)(H,18,19)
InChIKeyMLWGPMXSIGCTTI-UHFFFAOYSA-N
MW302.33 g/mol
LogP1.86
Rot. Bonds5

About N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(2-methoxyacetyl)amino]benzamide

N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(2-methoxyacetyl)amino]benzamide (PubChem CID 21369133) has the molecular formula C15H18N4O3 and a molecular weight of 302.33 g/mol. Its IUPAC name is N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(2-methoxyacetyl)amino]benzamide.

Molecular Properties

Compound NameN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(2-methoxyacetyl)amino]benzamide
PubChem CID21369133
Molecular FormulaC15H18N4O3
Molecular Weight302.33 g/mol
Exact Mass302.14
IUPAC NameN-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(2-methoxyacetyl)amino]benzamide
SMILESCOCC(=O)Nc1ccccc1C(=O)Nc1c(C)n[nH]c1C
InChIInChI=1S/C15H18N4O3/c1-9-14(10(2)19-18-9)17-15(21)11-6-4-5-7-12(11)16-13(20)8-22-3/h4-7H,8H2,1-3H3,(H,16,20)(H,17,21)(H,18,19)
InChIKeyMLWGPMXSIGCTTI-UHFFFAOYSA-N
XLogP1.86
TPSA96.11 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 51.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(propylamino)benzamide
CID 62167844
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(trifluoromethyl)benzamide
CID 43546989
2-[(2-methoxyacetyl)amino]-N-pyridin-3-ylbenzamide
CID 30337604
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(2-hydroxyphenoxy)acetamide
CID 43546519
2-chloro-N-(3,5-dimethyl-1H-pyrazol-4-yl)pyridine-3-carboxamide
CID 43547697
[2-[(E)-3-[2-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl]anilino]-3-oxoprop-1-enyl]phenyl] benzoate
CID 21369149
2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-3-fluorobenzamide
CID 62662395
N-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)carbamoyl]phenyl]naphthalene-1-carboxamide
CID 21369028
N-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenyl]-2-methoxyacetamide
CID 24697766
N-(3,5-dimethyl-1H-pyrazol-4-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 43582921
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(2-nitrophenyl)sulfonylamino]benzamide
CID 21369135
2-benzamido-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide
CID 46579689

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(2-methoxyacetyl)amino]benzamide?
The IUPAC name of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(2-methoxyacetyl)amino]benzamide (CID 21369133) is N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(2-methoxyacetyl)amino]benzamide.
What is the SMILES notation for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(2-methoxyacetyl)amino]benzamide?
The canonical SMILES for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(2-methoxyacetyl)amino]benzamide is COCC(=O)Nc1ccccc1C(=O)Nc1c(C)n[nH]c1C.
What is the InChIKey of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(2-methoxyacetyl)amino]benzamide?
The InChIKey is MLWGPMXSIGCTTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O3/c1-9-14(10(2)19-18-9)17-15(21)11-6-4-5-7-12(11)16-13(20)8-22-3/h4-7H,8H2,1-3H3,(H,16,20)(H,17,21)(H,18,19).
What are the key properties of N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(2-methoxyacetyl)amino]benzamide?
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(2-methoxyacetyl)amino]benzamide has a molecular weight of 302.33 g/mol, XLogP of 1.86, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[(2-methoxyacetyl)amino]benzamide is sourced from PubChem (CID 21369133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).