5-bromo-N-(2-hydroxypentyl)pyridine-2-carboxamide

C11H15BrN2O2 — CID 115700916

IUPAC5-bromo-N-(2-hydroxypentyl)pyridine-2-carboxamide
SMILESCCCC(O)CNC(=O)c1ccc(Br)cn1
InChIInChI=1S/C11H15BrN2O2/c1-2-3-9(15)7-14-11(16)10-5-4-8(12)6-13-10/h4-6,9,15H,2-3,7H2,1H3,(H,14,16)
InChIKeyJHGRRDNNWFLSFT-UHFFFAOYSA-N
MW287.16 g/mol
LogP1.73
Rot. Bonds5

About 5-bromo-N-(2-hydroxypentyl)pyridine-2-carboxamide

5-bromo-N-(2-hydroxypentyl)pyridine-2-carboxamide (PubChem CID 115700916) has the molecular formula C11H15BrN2O2 and a molecular weight of 287.16 g/mol. Its IUPAC name is 5-bromo-N-(2-hydroxypentyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(2-hydroxypentyl)pyridine-2-carboxamide
PubChem CID115700916
Molecular FormulaC11H15BrN2O2
Molecular Weight287.16 g/mol
Exact Mass286.03
IUPAC Name5-bromo-N-(2-hydroxypentyl)pyridine-2-carboxamide
SMILESCCCC(O)CNC(=O)c1ccc(Br)cn1
InChIInChI=1S/C11H15BrN2O2/c1-2-3-9(15)7-14-11(16)10-5-4-8(12)6-13-10/h4-6,9,15H,2-3,7H2,1H3,(H,14,16)
InChIKeyJHGRRDNNWFLSFT-UHFFFAOYSA-N
XLogP1.73
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.16
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-[(2S)-2,3-dihydroxypropyl]pyridine-2-carboxamide
CID 124510748
5-bromo-N-(2-methylbutyl)pyridine-2-carboxamide
CID 55210499
N-(2-aminobutyl)-5-bromopyridine-2-carboxamide
CID 63731150
5-bromo-N-(2,3-dimethylbutyl)pyridine-2-carboxamide
CID 64596698
5-bromo-N-(2,2-difluoroethyl)pyridine-2-carboxamide
CID 79080153
4-bromo-2-chloro-N-(2-hydroxypentyl)benzamide
CID 113258679
5-bromo-N-(2-methylsulfanylpropyl)pyridine-2-carboxamide
CID 115759469
(2R)-2-[(5-bromopyridine-2-carbonyl)amino]pentanoic acid
CID 107562920
5-bromo-N-(2-bromo-3-methoxypropyl)pyridine-2-carboxamide
CID 114309929
3,5-dibromo-N-(2-hydroxypentyl)benzamide
CID 103909287
5-bromo-N-heptan-2-ylpyridine-2-carboxamide
CID 55153825
N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-5-bromopyridine-2-carboxamide
CID 119526197

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(2-hydroxypentyl)pyridine-2-carboxamide?
The IUPAC name of 5-bromo-N-(2-hydroxypentyl)pyridine-2-carboxamide (CID 115700916) is 5-bromo-N-(2-hydroxypentyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(2-hydroxypentyl)pyridine-2-carboxamide?
The canonical SMILES for 5-bromo-N-(2-hydroxypentyl)pyridine-2-carboxamide is CCCC(O)CNC(=O)c1ccc(Br)cn1.
What is the InChIKey of 5-bromo-N-(2-hydroxypentyl)pyridine-2-carboxamide?
The InChIKey is JHGRRDNNWFLSFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2O2/c1-2-3-9(15)7-14-11(16)10-5-4-8(12)6-13-10/h4-6,9,15H,2-3,7H2,1H3,(H,14,16).
What are the key properties of 5-bromo-N-(2-hydroxypentyl)pyridine-2-carboxamide?
5-bromo-N-(2-hydroxypentyl)pyridine-2-carboxamide has a molecular weight of 287.16 g/mol, XLogP of 1.73, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(2-hydroxypentyl)pyridine-2-carboxamide is sourced from PubChem (CID 115700916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).