5-chloro-N-[(2R)-1-hydroxybutan-2-yl]pyridine-2-carboxamide

C10H13ClN2O2 — CID 103920023

IUPAC5-chloro-N-[(2R)-1-hydroxybutan-2-yl]pyridine-2-carboxamide
SMILESCC[C@H](CO)NC(=O)c1ccc(Cl)cn1
InChIInChI=1S/C10H13ClN2O2/c1-2-8(6-14)13-10(15)9-4-3-7(11)5-12-9/h3-5,8,14H,2,6H2,1H3,(H,13,15)/t8-/m1/s1
InChIKeyNKXSHNPEGIWIPI-MRVPVSSYSA-N
MW228.68 g/mol
LogP1.24
Rot. Bonds4

About 5-chloro-N-[(2R)-1-hydroxybutan-2-yl]pyridine-2-carboxamide

5-chloro-N-[(2R)-1-hydroxybutan-2-yl]pyridine-2-carboxamide (PubChem CID 103920023) has the molecular formula C10H13ClN2O2 and a molecular weight of 228.68 g/mol. Its IUPAC name is 5-chloro-N-[(2R)-1-hydroxybutan-2-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[(2R)-1-hydroxybutan-2-yl]pyridine-2-carboxamide
PubChem CID103920023
Molecular FormulaC10H13ClN2O2
Molecular Weight228.68 g/mol
Exact Mass228.07
IUPAC Name5-chloro-N-[(2R)-1-hydroxybutan-2-yl]pyridine-2-carboxamide
SMILESCC[C@H](CO)NC(=O)c1ccc(Cl)cn1
InChIInChI=1S/C10H13ClN2O2/c1-2-8(6-14)13-10(15)9-4-3-7(11)5-12-9/h3-5,8,14H,2,6H2,1H3,(H,13,15)/t8-/m1/s1
InChIKeyNKXSHNPEGIWIPI-MRVPVSSYSA-N
XLogP1.24
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.68
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-chloro-N-(1-hydroxybutan-2-yl)pyridazine-3-carboxamide
CID 61041980
N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide
CID 43392707
5-(methylamino)-N-pentan-3-ylpyridine-2-carboxamide
CID 104639887
N-(1-hydroxybutan-2-yl)-6-oxo-1H-pyrazine-3-carboxamide
CID 43500413
6-chloro-N-(1-hydroxybutan-2-yl)pyridine-2-carboxamide
CID 62239936
5-chloro-N-(4-hydroxy-3-methylsulfanylbutan-2-yl)pyridine-2-carboxamide
CID 75384422
5,6-dichloro-N-[(2R)-1-hydroxybutan-2-yl]pyridine-3-carboxamide
CID 93040790
5-chloro-N-(1-hydroxy-4-methylpentan-3-yl)pyridine-2-carboxamide
CID 103782372
6-amino-N-[(2S)-1-hydroxybutan-2-yl]pyridine-3-carboxamide
CID 124514500
5-bromo-N-(1-chlorobutan-2-yl)pyridine-2-carboxamide
CID 114294391
3,4,5-trichloro-N-[(2S)-1-hydroxybutan-2-yl]pyridine-2-carboxamide
CID 93041499
5-chloro-N-(1-hydroxypentan-3-yl)pyrazine-2-carboxamide
CID 107258073

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[(2R)-1-hydroxybutan-2-yl]pyridine-2-carboxamide?
The IUPAC name of 5-chloro-N-[(2R)-1-hydroxybutan-2-yl]pyridine-2-carboxamide (CID 103920023) is 5-chloro-N-[(2R)-1-hydroxybutan-2-yl]pyridine-2-carboxamide.
What is the SMILES notation for 5-chloro-N-[(2R)-1-hydroxybutan-2-yl]pyridine-2-carboxamide?
The canonical SMILES for 5-chloro-N-[(2R)-1-hydroxybutan-2-yl]pyridine-2-carboxamide is CC[C@H](CO)NC(=O)c1ccc(Cl)cn1.
What is the InChIKey of 5-chloro-N-[(2R)-1-hydroxybutan-2-yl]pyridine-2-carboxamide?
The InChIKey is NKXSHNPEGIWIPI-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H13ClN2O2/c1-2-8(6-14)13-10(15)9-4-3-7(11)5-12-9/h3-5,8,14H,2,6H2,1H3,(H,13,15)/t8-/m1/s1.
What are the key properties of 5-chloro-N-[(2R)-1-hydroxybutan-2-yl]pyridine-2-carboxamide?
5-chloro-N-[(2R)-1-hydroxybutan-2-yl]pyridine-2-carboxamide has a molecular weight of 228.68 g/mol, XLogP of 1.24, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[(2R)-1-hydroxybutan-2-yl]pyridine-2-carboxamide is sourced from PubChem (CID 103920023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).