N-(2-hydroxypropyl)-3-(5-phenylpyrazol-1-yl)benzamide

C19H19N3O2 — CID 110906604

IUPACN-(2-hydroxypropyl)-3-(5-phenylpyrazol-1-yl)benzamide
SMILESCC(O)CNC(=O)c1cccc(-n2nccc2-c2ccccc2)c1
InChIInChI=1S/C19H19N3O2/c1-14(23)13-20-19(24)16-8-5-9-17(12-16)22-18(10-11-21-22)15-6-3-2-4-7-15/h2-12,14,23H,13H2,1H3,(H,20,24)
InChIKeyOHGJMGHZABLDPO-UHFFFAOYSA-N
MW321.38 g/mol
LogP2.65
Rot. Bonds5

About N-(2-hydroxypropyl)-3-(5-phenylpyrazol-1-yl)benzamide

N-(2-hydroxypropyl)-3-(5-phenylpyrazol-1-yl)benzamide (PubChem CID 110906604) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is N-(2-hydroxypropyl)-3-(5-phenylpyrazol-1-yl)benzamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-3-(5-phenylpyrazol-1-yl)benzamide
PubChem CID110906604
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC NameN-(2-hydroxypropyl)-3-(5-phenylpyrazol-1-yl)benzamide
SMILESCC(O)CNC(=O)c1cccc(-n2nccc2-c2ccccc2)c1
InChIInChI=1S/C19H19N3O2/c1-14(23)13-20-19(24)16-8-5-9-17(12-16)22-18(10-11-21-22)15-6-3-2-4-7-15/h2-12,14,23H,13H2,1H3,(H,20,24)
InChIKeyOHGJMGHZABLDPO-UHFFFAOYSA-N
XLogP2.65
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(5-phenylpyrazol-1-yl)benzoic acid
CID 16773226
N-[(1R)-1-(1,2-oxazol-3-yl)ethyl]-3-(5-phenylpyrazol-1-yl)benzamide
CID 97089380
N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]-3-(5-phenylpyrazol-1-yl)benzamide
CID 95591250
3-[3-(5-phenylpyrazol-1-yl)phenyl]benzoic acid
CID 118577261
N-(5-methyl-1H-pyrazol-3-yl)-3-(5-phenylpyrazol-1-yl)benzamide
CID 47925828
methyl 4-[[3-(5-phenylpyrazol-1-yl)benzoyl]amino]piperidine-1-carboxylate
CID 47897961
3-(5-phenylpyrazol-1-yl)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119460163
N-[(2S)-2-hydroxypropyl]-1-phenylpyrazole-4-carboxamide
CID 83030878
N-(1-oxothiolan-3-yl)-3-(5-phenylpyrazol-1-yl)benzamide
CID 71864177
N-(2-hydroxypropyl)-4-phenylbenzamide
CID 43391038
3-(5-phenylpyrazol-1-yl)-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)benzamide
CID 47076780
3-[5-(4-fluorophenyl)pyrazol-1-yl]benzoic acid
CID 16776531

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-3-(5-phenylpyrazol-1-yl)benzamide?
The IUPAC name of N-(2-hydroxypropyl)-3-(5-phenylpyrazol-1-yl)benzamide (CID 110906604) is N-(2-hydroxypropyl)-3-(5-phenylpyrazol-1-yl)benzamide.
What is the SMILES notation for N-(2-hydroxypropyl)-3-(5-phenylpyrazol-1-yl)benzamide?
The canonical SMILES for N-(2-hydroxypropyl)-3-(5-phenylpyrazol-1-yl)benzamide is CC(O)CNC(=O)c1cccc(-n2nccc2-c2ccccc2)c1.
What is the InChIKey of N-(2-hydroxypropyl)-3-(5-phenylpyrazol-1-yl)benzamide?
The InChIKey is OHGJMGHZABLDPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-14(23)13-20-19(24)16-8-5-9-17(12-16)22-18(10-11-21-22)15-6-3-2-4-7-15/h2-12,14,23H,13H2,1H3,(H,20,24).
What are the key properties of N-(2-hydroxypropyl)-3-(5-phenylpyrazol-1-yl)benzamide?
N-(2-hydroxypropyl)-3-(5-phenylpyrazol-1-yl)benzamide has a molecular weight of 321.38 g/mol, XLogP of 2.65, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)-3-(5-phenylpyrazol-1-yl)benzamide is sourced from PubChem (CID 110906604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).