N-(2-hydroxypropyl)-2-methyl-3-pyridin-2-ylbenzamide

C16H18N2O2 — CID 109399313

IUPACN-(2-hydroxypropyl)-2-methyl-3-pyridin-2-ylbenzamide
SMILESCc1c(C(=O)NCC(C)O)cccc1-c1ccccn1
InChIInChI=1S/C16H18N2O2/c1-11(19)10-18-16(20)14-7-5-6-13(12(14)2)15-8-3-4-9-17-15/h3-9,11,19H,10H2,1-2H3,(H,18,20)
InChIKeyIVBWXHMCUKMNEX-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.17
Rot. Bonds4

About N-(2-hydroxypropyl)-2-methyl-3-pyridin-2-ylbenzamide

N-(2-hydroxypropyl)-2-methyl-3-pyridin-2-ylbenzamide (PubChem CID 109399313) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-(2-hydroxypropyl)-2-methyl-3-pyridin-2-ylbenzamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-2-methyl-3-pyridin-2-ylbenzamide
PubChem CID109399313
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-(2-hydroxypropyl)-2-methyl-3-pyridin-2-ylbenzamide
SMILESCc1c(C(=O)NCC(C)O)cccc1-c1ccccn1
InChIInChI=1S/C16H18N2O2/c1-11(19)10-18-16(20)14-7-5-6-13(12(14)2)15-8-3-4-9-17-15/h3-9,11,19H,10H2,1-2H3,(H,18,20)
InChIKeyIVBWXHMCUKMNEX-UHFFFAOYSA-N
XLogP2.17
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxypentyl)-2-methyl-3-pyridin-2-ylbenzamide
CID 109399496
N-[[2-(hydroxymethyl)phenyl]methyl]-2-methyl-3-pyridin-2-ylbenzamide
CID 109399422
2,2-dimethyl-3-[(2-methyl-3-pyridin-2-ylbenzoyl)amino]propanoic acid
CID 120527980
N-[(1-methoxycyclobutyl)methyl]-2-methyl-3-pyridin-2-ylbenzamide
CID 136521765
2-chloro-N-[(2R)-2-hydroxypropyl]pyridine-3-carboxamide
CID 93419851
N-[(1R)-2-amino-2-oxo-1-phenylethyl]-2-methyl-3-pyridin-2-ylbenzamide
CID 97242872
2-bromo-N-[(2R)-2-hydroxypropyl]pyridine-3-carboxamide
CID 103886003
N-(3-cyanothiolan-3-yl)-2-methyl-3-pyridin-2-ylbenzamide
CID 75389234
N-[(2R)-2-hydroxypropyl]-2-methylsulfanylpyridine-3-carboxamide
CID 83032320
2,3-dihydroxy-N-(2-hydroxypropyl)benzamide
CID 114344897
2-amino-N-(2-hydroxypropyl)benzamide
CID 12562298
2-fluoro-N-(2-hydroxypropyl)benzamide
CID 43391205

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-2-methyl-3-pyridin-2-ylbenzamide?
The IUPAC name of N-(2-hydroxypropyl)-2-methyl-3-pyridin-2-ylbenzamide (CID 109399313) is N-(2-hydroxypropyl)-2-methyl-3-pyridin-2-ylbenzamide.
What is the SMILES notation for N-(2-hydroxypropyl)-2-methyl-3-pyridin-2-ylbenzamide?
The canonical SMILES for N-(2-hydroxypropyl)-2-methyl-3-pyridin-2-ylbenzamide is Cc1c(C(=O)NCC(C)O)cccc1-c1ccccn1.
What is the InChIKey of N-(2-hydroxypropyl)-2-methyl-3-pyridin-2-ylbenzamide?
The InChIKey is IVBWXHMCUKMNEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-11(19)10-18-16(20)14-7-5-6-13(12(14)2)15-8-3-4-9-17-15/h3-9,11,19H,10H2,1-2H3,(H,18,20).
What are the key properties of N-(2-hydroxypropyl)-2-methyl-3-pyridin-2-ylbenzamide?
N-(2-hydroxypropyl)-2-methyl-3-pyridin-2-ylbenzamide has a molecular weight of 270.33 g/mol, XLogP of 2.17, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)-2-methyl-3-pyridin-2-ylbenzamide is sourced from PubChem (CID 109399313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).