N-(3-hydroxy-2-pyridinyl)-4-propan-2-ylbenzamide

C15H16N2O2 — CID 25333159

IUPACN-(3-hydroxy-2-pyridinyl)-4-propan-2-ylbenzamide
SMILESCC(C)c1ccc(C(=O)Nc2ncccc2O)cc1
InChIInChI=1S/C15H16N2O2/c1-10(2)11-5-7-12(8-6-11)15(19)17-14-13(18)4-3-9-16-14/h3-10,18H,1-2H3,(H,16,17,19)
InChIKeyNSVDNBGUYMBBOB-UHFFFAOYSA-N
MW256.31 g/mol
LogP3.16
Rot. Bonds3

About N-(3-hydroxy-2-pyridinyl)-4-propan-2-ylbenzamide

N-(3-hydroxy-2-pyridinyl)-4-propan-2-ylbenzamide (PubChem CID 25333159) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is N-(3-hydroxy-2-pyridinyl)-4-propan-2-ylbenzamide.

Molecular Properties

Compound NameN-(3-hydroxy-2-pyridinyl)-4-propan-2-ylbenzamide
PubChem CID25333159
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC NameN-(3-hydroxy-2-pyridinyl)-4-propan-2-ylbenzamide
SMILESCC(C)c1ccc(C(=O)Nc2ncccc2O)cc1
InChIInChI=1S/C15H16N2O2/c1-10(2)11-5-7-12(8-6-11)15(19)17-14-13(18)4-3-9-16-14/h3-10,18H,1-2H3,(H,16,17,19)
InChIKeyNSVDNBGUYMBBOB-UHFFFAOYSA-N
XLogP3.16
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-hydroxy-2-pyridinyl)-4-methylbenzamide
CID 25342946
N-(3-hydroxy-2-pyridinyl)pyridine-4-carboxamide
CID 30160671
3-[(4-propan-2-ylbenzoyl)amino]pyrazine-2-carboxylic acid
CID 63262062
N-(3-hydroxy-2-pyridinyl)-3-methoxy-4-propan-2-yloxybenzamide
CID 46663784
2-[(4-hydroxybenzoyl)amino]-N-methylpyridine-3-carboxamide
CID 13072444
3,4,5-triethoxy-N-(3-hydroxy-2-pyridinyl)benzamide
CID 18109391
4-propan-2-yl-N-(4-propan-2-ylphenyl)benzamide
CID 1406437
(2S)-2-amino-N-(3-hydroxy-2-pyridinyl)propanamide
CID 103630280
N-(3-hydroxy-2-pyridinyl)-4-(1H-pyrazol-4-yl)benzamide
CID 110464333
4-(cyclopropylmethoxy)-N-(3-hydroxy-2-pyridinyl)benzamide
CID 60572307
3-(dimethylamino)-N-(3-hydroxy-2-pyridinyl)benzamide
CID 30160840
N-(3-hydroxy-2-pyridinyl)-1H-pyrrole-2-carboxamide
CID 110461050

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-2-pyridinyl)-4-propan-2-ylbenzamide?
The IUPAC name of N-(3-hydroxy-2-pyridinyl)-4-propan-2-ylbenzamide (CID 25333159) is N-(3-hydroxy-2-pyridinyl)-4-propan-2-ylbenzamide.
What is the SMILES notation for N-(3-hydroxy-2-pyridinyl)-4-propan-2-ylbenzamide?
The canonical SMILES for N-(3-hydroxy-2-pyridinyl)-4-propan-2-ylbenzamide is CC(C)c1ccc(C(=O)Nc2ncccc2O)cc1.
What is the InChIKey of N-(3-hydroxy-2-pyridinyl)-4-propan-2-ylbenzamide?
The InChIKey is NSVDNBGUYMBBOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-10(2)11-5-7-12(8-6-11)15(19)17-14-13(18)4-3-9-16-14/h3-10,18H,1-2H3,(H,16,17,19).
What are the key properties of N-(3-hydroxy-2-pyridinyl)-4-propan-2-ylbenzamide?
N-(3-hydroxy-2-pyridinyl)-4-propan-2-ylbenzamide has a molecular weight of 256.31 g/mol, XLogP of 3.16, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-2-pyridinyl)-4-propan-2-ylbenzamide is sourced from PubChem (CID 25333159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).