2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(R)-phenyl(pyridin-3-yl)methyl]acetamide

C19H20N4O — CID 99832422

IUPAC2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(R)-phenyl(pyridin-3-yl)methyl]acetamide
SMILESCc1n[nH]c(C)c1CC(=O)N[C@H](c1ccccc1)c1cccnc1
InChIInChI=1S/C19H20N4O/c1-13-17(14(2)23-22-13)11-18(24)21-19(15-7-4-3-5-8-15)16-9-6-10-20-12-16/h3-10,12,19H,11H2,1-2H3,(H,21,24)(H,22,23)/t19-/m1/s1
InChIKeyFOWIELUVXQTPRL-LJQANCHMSA-N
MW320.40 g/mol
LogP2.87
Rot. Bonds5

About 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(R)-phenyl(pyridin-3-yl)methyl]acetamide

2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(R)-phenyl(pyridin-3-yl)methyl]acetamide (PubChem CID 99832422) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(R)-phenyl(pyridin-3-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(R)-phenyl(pyridin-3-yl)methyl]acetamide
PubChem CID99832422
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC Name2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(R)-phenyl(pyridin-3-yl)methyl]acetamide
SMILESCc1n[nH]c(C)c1CC(=O)N[C@H](c1ccccc1)c1cccnc1
InChIInChI=1S/C19H20N4O/c1-13-17(14(2)23-22-13)11-18(24)21-19(15-7-4-3-5-8-15)16-9-6-10-20-12-16/h3-10,12,19H,11H2,1-2H3,(H,21,24)(H,22,23)/t19-/m1/s1
InChIKeyFOWIELUVXQTPRL-LJQANCHMSA-N
XLogP2.87
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(2R,3S)-3-hydroxy-4-phenylbutan-2-yl]acetamide
CID 99825884
N-[(4-fluorophenyl)-pyridin-3-ylmethyl]-2-(4-hydroxyphenyl)acetamide
CID 75380343
2-(2-methoxyethylamino)-N-[phenyl(pyridin-3-yl)methyl]acetamide
CID 119875696
(3S)-N-[(R)-phenyl(pyridin-3-yl)methyl]-3-(3,4,5-trimethylpyrazol-1-yl)butanamide
CID 51495763
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(2S)-2-phenylbutan-2-yl]acetamide
CID 100671479
2-(2-methoxyanilino)-N-[(S)-phenyl(pyridin-3-yl)methyl]acetamide
CID 96533957
2-methyl-3-(methylamino)-N-[phenyl(pyridin-3-yl)methyl]propanamide
CID 119875686
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4-phenylphenyl)acetamide
CID 9319157
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3,3-diphenylpropanamide
CID 110444644
N-[(S)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide
CID 92500168
N-[(4-chlorophenyl)-pyridin-3-ylmethyl]-2-(4-methylphenoxy)acetamide
CID 20897097
2-(2-phenylimidazol-1-yl)-N-[(R)-phenyl(pyridin-3-yl)methyl]acetamide
CID 51492898

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(R)-phenyl(pyridin-3-yl)methyl]acetamide?
The IUPAC name of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(R)-phenyl(pyridin-3-yl)methyl]acetamide (CID 99832422) is 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(R)-phenyl(pyridin-3-yl)methyl]acetamide.
What is the SMILES notation for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(R)-phenyl(pyridin-3-yl)methyl]acetamide?
The canonical SMILES for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(R)-phenyl(pyridin-3-yl)methyl]acetamide is Cc1n[nH]c(C)c1CC(=O)N[C@H](c1ccccc1)c1cccnc1.
What is the InChIKey of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(R)-phenyl(pyridin-3-yl)methyl]acetamide?
The InChIKey is FOWIELUVXQTPRL-LJQANCHMSA-N. The full InChI is InChI=1S/C19H20N4O/c1-13-17(14(2)23-22-13)11-18(24)21-19(15-7-4-3-5-8-15)16-9-6-10-20-12-16/h3-10,12,19H,11H2,1-2H3,(H,21,24)(H,22,23)/t19-/m1/s1.
What are the key properties of 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(R)-phenyl(pyridin-3-yl)methyl]acetamide?
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(R)-phenyl(pyridin-3-yl)methyl]acetamide has a molecular weight of 320.40 g/mol, XLogP of 2.87, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[(R)-phenyl(pyridin-3-yl)methyl]acetamide is sourced from PubChem (CID 99832422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).