N-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide

C11H16N2O3 — CID 103799473

IUPACN-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide
SMILESCOCC(CCO)NC(=O)c1ccncc1
InChIInChI=1S/C11H16N2O3/c1-16-8-10(4-7-14)13-11(15)9-2-5-12-6-3-9/h2-3,5-6,10,14H,4,7-8H2,1H3,(H,13,15)
InChIKeyCYOOAQMMNSGFBZ-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.21
Rot. Bonds6

About N-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide

N-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide (PubChem CID 103799473) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is N-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide
PubChem CID103799473
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC NameN-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide
SMILESCOCC(CCO)NC(=O)c1ccncc1
InChIInChI=1S/C11H16N2O3/c1-16-8-10(4-7-14)13-11(15)9-2-5-12-6-3-9/h2-3,5-6,10,14H,4,7-8H2,1H3,(H,13,15)
InChIKeyCYOOAQMMNSGFBZ-UHFFFAOYSA-N
XLogP0.21
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-hydroxy-1-methoxybutan-2-yl)pyrimidine-5-carboxamide
CID 104629797
3-hydroxy-N-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide
CID 103862917
2-(dimethylamino)-N-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide
CID 103799343
N-(4-hydroxy-1-methoxybutan-2-yl)-6-methylpyridine-3-carboxamide
CID 103799620
N-(4-hydroxy-1-methoxybutan-2-yl)-4-(trifluoromethoxy)benzamide
CID 103799562
3-hydroxy-N-(4-hydroxy-1-methoxybutan-2-yl)-4-iodobenzamide
CID 113434933
3-fluoro-N-(4-hydroxy-1-methoxybutan-2-yl)-4-methylbenzamide
CID 113264488
N-pentan-3-ylpyridine-4-carboxamide
CID 137320352
4-amino-3-fluoro-N-(4-hydroxy-1-methoxybutan-2-yl)benzamide
CID 106151971
3-chloro-N-(4-hydroxy-1-methoxybutan-2-yl)-4-iodobenzamide
CID 103851083
4-fluoro-N-(4-hydroxy-1-methoxybutan-2-yl)-3-methoxybenzamide
CID 103850770
2-bromo-N-(4-hydroxy-1-methoxybutan-2-yl)furan-3-carboxamide
CID 106899013

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide?
The IUPAC name of N-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide (CID 103799473) is N-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide.
What is the SMILES notation for N-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide?
The canonical SMILES for N-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide is COCC(CCO)NC(=O)c1ccncc1.
What is the InChIKey of N-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide?
The InChIKey is CYOOAQMMNSGFBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-16-8-10(4-7-14)13-11(15)9-2-5-12-6-3-9/h2-3,5-6,10,14H,4,7-8H2,1H3,(H,13,15).
What are the key properties of N-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide?
N-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide has a molecular weight of 224.26 g/mol, XLogP of 0.21, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxy-1-methoxybutan-2-yl)pyridine-4-carboxamide is sourced from PubChem (CID 103799473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).