N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide

C10H14N2O2 — CID 43392707

IUPACN-(1-hydroxybutan-2-yl)pyridine-2-carboxamide
SMILESCCC(CO)NC(=O)c1ccccn1
InChIInChI=1S/C10H14N2O2/c1-2-8(7-13)12-10(14)9-5-3-4-6-11-9/h3-6,8,13H,2,7H2,1H3,(H,12,14)
InChIKeyZBGAUVKIFIJDSL-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.58
Rot. Bonds4

About N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide

N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide (PubChem CID 43392707) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxybutan-2-yl)pyridine-2-carboxamide
PubChem CID43392707
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC NameN-(1-hydroxybutan-2-yl)pyridine-2-carboxamide
SMILESCCC(CO)NC(=O)c1ccccn1
InChIInChI=1S/C10H14N2O2/c1-2-8(7-13)12-10(14)9-5-3-4-6-11-9/h3-6,8,13H,2,7H2,1H3,(H,12,14)
InChIKeyZBGAUVKIFIJDSL-UHFFFAOYSA-N
XLogP0.58
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-bromobutan-2-yl)pyridine-2-carboxamide
CID 114307782
N-(1-hydroxy-3-phenylpropan-2-yl)pyridine-2-carboxamide
CID 55169382
6-chloro-N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide
CID 62239936
N-(1-phenylpropyl)pyridine-2-carboxamide
CID 5305559
3-hydroxy-N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide
CID 60923596
5-chloro-N-[(2R)-1-hydroxybutan-2-yl]pyridine-2-carboxamide
CID 103920023
ethyl 3-hydroxy-2-(pyridine-2-carbonylamino)propanoate
CID 70817337
N-[(2S)-1-hydroxybutan-2-yl]-3-methylpyridine-2-carboxamide
CID 104981219
6-chloro-N-(1-hydroxybutan-2-yl)pyridazine-3-carboxamide
CID 61041980
N-[(2S)-1-hydroxybutan-2-yl]benzamide
CID 13129547
(2R,3R)-3-methyl-2-(pyridine-2-carbonylamino)pentanoic acid
CID 30054086
(2R,3S)-3-methyl-2-(pyridine-2-carbonylamino)pentanoic acid
CID 30054092

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide?
The IUPAC name of N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide (CID 43392707) is N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide?
The canonical SMILES for N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide is CCC(CO)NC(=O)c1ccccn1.
What is the InChIKey of N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide?
The InChIKey is ZBGAUVKIFIJDSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-2-8(7-13)12-10(14)9-5-3-4-6-11-9/h3-6,8,13H,2,7H2,1H3,(H,12,14).
What are the key properties of N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide?
N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide has a molecular weight of 194.23 g/mol, XLogP of 0.58, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 43392707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).