N-(2-hydroxypentyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide

C15H24N2O3 — CID 110000216

IUPACN-(2-hydroxypentyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide
SMILESCCCC(O)CNC(=O)c1ccc(OC(C)(C)C)nc1
InChIInChI=1S/C15H24N2O3/c1-5-6-12(18)10-17-14(19)11-7-8-13(16-9-11)20-15(2,3)4/h7-9,12,18H,5-6,10H2,1-4H3,(H,17,19)
InChIKeyCORJOKIECXJJPE-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.15
Rot. Bonds6

About N-(2-hydroxypentyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide

N-(2-hydroxypentyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide (PubChem CID 110000216) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is N-(2-hydroxypentyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxypentyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide
PubChem CID110000216
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC NameN-(2-hydroxypentyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide
SMILESCCCC(O)CNC(=O)c1ccc(OC(C)(C)C)nc1
InChIInChI=1S/C15H24N2O3/c1-5-6-12(18)10-17-14(19)11-7-8-13(16-9-11)20-15(2,3)4/h7-9,12,18H,5-6,10H2,1-4H3,(H,17,19)
InChIKeyCORJOKIECXJJPE-UHFFFAOYSA-N
XLogP2.15
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxy-3,3-dimethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide
CID 110000209
N-(2-ethylbutyl)-6-methoxypyridine-3-carboxamide
CID 113232040
N-(2-hydroxypentyl)-4-(propan-2-yloxymethyl)benzamide
CID 115700661
6-methoxy-N-(3-methyl-2-propan-2-ylbutyl)pyridine-3-carboxamide
CID 102914743
N-(3-hydroxy-4-methoxybutyl)-6-methoxypyridine-3-carboxamide
CID 103877604
3,5-dibromo-N-(2-hydroxypentyl)benzamide
CID 103909287
4-bromo-N-(2-hydroxypentyl)-3,5-dimethoxybenzamide
CID 115700732
5-bromo-N-(2-hydroxypentyl)pyridine-2-carboxamide
CID 115700916
N-(2-hydroxypropyl)-6-phenoxypyridine-3-carboxamide
CID 78888027
N-[[6-[(2-methylpropan-2-yl)oxy]-3-pyridinyl]methyl]pyridine-4-carboxamide
CID 86783842
N-tert-butyl-6-ethoxypyridine-3-carboxamide
CID 47244667
N-ethyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 70972173

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypentyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide?
The IUPAC name of N-(2-hydroxypentyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide (CID 110000216) is N-(2-hydroxypentyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide.
What is the SMILES notation for N-(2-hydroxypentyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide?
The canonical SMILES for N-(2-hydroxypentyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide is CCCC(O)CNC(=O)c1ccc(OC(C)(C)C)nc1.
What is the InChIKey of N-(2-hydroxypentyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide?
The InChIKey is CORJOKIECXJJPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-5-6-12(18)10-17-14(19)11-7-8-13(16-9-11)20-15(2,3)4/h7-9,12,18H,5-6,10H2,1-4H3,(H,17,19).
What are the key properties of N-(2-hydroxypentyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide?
N-(2-hydroxypentyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide has a molecular weight of 280.37 g/mol, XLogP of 2.15, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypentyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-3-carboxamide is sourced from PubChem (CID 110000216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).