3-chloro-4-hydroxy-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]benzamide

C16H17ClN4O4 — CID 136529096

IUPAC3-chloro-4-hydroxy-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]benzamide
SMILESO=C(Nc1cnn(CC(=O)N2CCOCC2)c1)c1ccc(O)c(Cl)c1
InChIInChI=1S/C16H17ClN4O4/c17-13-7-11(1-2-14(13)22)16(24)19-12-8-18-21(9-12)10-15(23)20-3-5-25-6-4-20/h1-2,7-9,22H,3-6,10H2,(H,19,24)
InChIKeyOXPJEJQTZXBZQR-UHFFFAOYSA-N
MW364.79 g/mol
LogP1.35
Rot. Bonds4

About 3-chloro-4-hydroxy-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]benzamide

3-chloro-4-hydroxy-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]benzamide (PubChem CID 136529096) has the molecular formula C16H17ClN4O4 and a molecular weight of 364.79 g/mol. Its IUPAC name is 3-chloro-4-hydroxy-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]benzamide.

Molecular Properties

Compound Name3-chloro-4-hydroxy-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]benzamide
PubChem CID136529096
Molecular FormulaC16H17ClN4O4
Molecular Weight364.79 g/mol
Exact Mass364.09
IUPAC Name3-chloro-4-hydroxy-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]benzamide
SMILESO=C(Nc1cnn(CC(=O)N2CCOCC2)c1)c1ccc(O)c(Cl)c1
InChIInChI=1S/C16H17ClN4O4/c17-13-7-11(1-2-14(13)22)16(24)19-12-8-18-21(9-12)10-15(23)20-3-5-25-6-4-20/h1-2,7-9,22H,3-6,10H2,(H,19,24)
InChIKeyOXPJEJQTZXBZQR-UHFFFAOYSA-N
XLogP1.35
TPSA96.69 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.79
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 3-chloro-4-hydroxy-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-chloro-N-cyclopropyl-4-hydroxy-N-[(1-methyl-1H-pyrazol-4-yl)methyl]benzamide
CID 56702352
2-[4-[(3-Chloro-4-prop-2-enoxyphenyl)methylamino]pyrazol-1-yl]-1-(2,6-dimethylmorpholin-4-yl)ethanone
CID 75393142
N-[1-[(2-chloro-4-fluorophenyl)methyl]pyrazol-4-yl]-4-hydroxybenzamide
CID 39854156
2-fluoro-4-hydroxy-N-[1-(2-methoxyethyl)pyrazol-4-yl]benzamide
CID 103940122
3-fluoro-4-hydroxy-N-[1-(oxan-2-yl)pyrazol-4-yl]benzamide
CID 126833842
3-chloro-N-cyclopentyl-4-{[1-(1H-pyrazol-1-ylacetyl)-4-piperidinyl]oxy}benzamide
CID 25383516
{3-[1-(3-chloro-4-hydroxybenzoyl)piperidin-3-yl]-1H-pyrazol-1-yl}acetic acid
CID 119071896
4-hydroxy-N-[1-[2-[methyl-[2-(4-methylphenoxy)ethyl]amino]-2-oxoethyl]pyrazol-4-yl]benzamide
CID 166148018
N-[1-[(3-chlorophenyl)methyl]pyrazol-4-yl]-4-ethoxybenzamide
CID 19338195
3-chloro-N-(2-methoxyethyl)-4-({1-[(1-methyl-1H-pyrazol-4-yl)methyl]-4-piperidinyl}oxy)benzamide
CID 25294616
3-chloro-N-(2-methoxyethyl)-4-[1-[(2S)-4-pyrazol-1-ylbutan-2-yl]piperidin-4-yl]oxybenzamide
CID 25454296
3-chloro-N-(2-methoxyethyl)-4-[1-[(2R)-4-pyrazol-1-ylbutan-2-yl]piperidin-4-yl]oxybenzamide
CID 25454300

Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-hydroxy-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]benzamide?
The IUPAC name of 3-chloro-4-hydroxy-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]benzamide (CID 136529096) is 3-chloro-4-hydroxy-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]benzamide.
What is the SMILES notation for 3-chloro-4-hydroxy-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]benzamide?
The canonical SMILES for 3-chloro-4-hydroxy-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]benzamide is O=C(Nc1cnn(CC(=O)N2CCOCC2)c1)c1ccc(O)c(Cl)c1.
What is the InChIKey of 3-chloro-4-hydroxy-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]benzamide?
The InChIKey is OXPJEJQTZXBZQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN4O4/c17-13-7-11(1-2-14(13)22)16(24)19-12-8-18-21(9-12)10-15(23)20-3-5-25-6-4-20/h1-2,7-9,22H,3-6,10H2,(H,19,24).
What are the key properties of 3-chloro-4-hydroxy-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]benzamide?
3-chloro-4-hydroxy-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]benzamide has a molecular weight of 364.79 g/mol, XLogP of 1.35, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-hydroxy-N-[1-(2-morpholin-4-yl-2-oxoethyl)pyrazol-4-yl]benzamide is sourced from PubChem (CID 136529096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).