N-[1-(4-bromophenyl)propan-2-yl]-5-hydroxypyridine-3-carboxamide

C15H15BrN2O2 — CID 63860266

IUPACN-[1-(4-bromophenyl)propan-2-yl]-5-hydroxypyridine-3-carboxamide
SMILESCC(Cc1ccc(Br)cc1)NC(=O)c1cncc(O)c1
InChIInChI=1S/C15H15BrN2O2/c1-10(6-11-2-4-13(16)5-3-11)18-15(20)12-7-14(19)9-17-8-12/h2-5,7-10,19H,6H2,1H3,(H,18,20)
InChIKeyAACGCJLTZWFHAZ-UHFFFAOYSA-N
MW335.20 g/mol
LogP2.91
Rot. Bonds4

About N-[1-(4-bromophenyl)propan-2-yl]-5-hydroxypyridine-3-carboxamide

N-[1-(4-bromophenyl)propan-2-yl]-5-hydroxypyridine-3-carboxamide (PubChem CID 63860266) has the molecular formula C15H15BrN2O2 and a molecular weight of 335.20 g/mol. Its IUPAC name is N-[1-(4-bromophenyl)propan-2-yl]-5-hydroxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(4-bromophenyl)propan-2-yl]-5-hydroxypyridine-3-carboxamide
PubChem CID63860266
Molecular FormulaC15H15BrN2O2
Molecular Weight335.20 g/mol
Exact Mass334.03
IUPAC NameN-[1-(4-bromophenyl)propan-2-yl]-5-hydroxypyridine-3-carboxamide
SMILESCC(Cc1ccc(Br)cc1)NC(=O)c1cncc(O)c1
InChIInChI=1S/C15H15BrN2O2/c1-10(6-11-2-4-13(16)5-3-11)18-15(20)12-7-14(19)9-17-8-12/h2-5,7-10,19H,6H2,1H3,(H,18,20)
InChIKeyAACGCJLTZWFHAZ-UHFFFAOYSA-N
XLogP2.91
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.20
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2R)-1-(4-bromophenyl)propan-2-yl]pyridine-3-carboxamide
CID 51948817
N-[1-(3-fluorophenyl)propan-2-yl]-5-hydroxypyridine-3-carboxamide
CID 142308444
5-hydroxy-N-(4-hydroxybutan-2-yl)pyridine-3-carboxamide
CID 115283714
5-bromo-N-[(2R)-1-(furan-3-yl)propan-2-yl]pyridine-3-carboxamide
CID 97030221
5-hydroxy-N-propan-2-ylpyridine-3-carboxamide
CID 63864751
5-hydroxy-N-[1-(2-methoxyphenyl)propan-2-yl]pyridine-3-carboxamide
CID 63859035
5-bromo-N-[1-(4-bromophenyl)propan-2-yl]pyridine-2-carboxamide
CID 62953884
4-bromo-N-[1-(4-bromophenyl)propan-2-yl]-1H-pyrrole-2-carboxamide
CID 47210992
N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide
CID 63851687
5-bromo-N-[1-(2-methylphenyl)propan-2-yl]pyridine-3-carboxamide
CID 47296504
N-[(2S)-1-(4-bromophenyl)propan-2-yl]-3-cyanobenzamide
CID 51948764
5-bromo-N-(5-methylhexan-2-yl)pyridine-3-carboxamide
CID 60628143

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-bromophenyl)propan-2-yl]-5-hydroxypyridine-3-carboxamide?
The IUPAC name of N-[1-(4-bromophenyl)propan-2-yl]-5-hydroxypyridine-3-carboxamide (CID 63860266) is N-[1-(4-bromophenyl)propan-2-yl]-5-hydroxypyridine-3-carboxamide.
What is the SMILES notation for N-[1-(4-bromophenyl)propan-2-yl]-5-hydroxypyridine-3-carboxamide?
The canonical SMILES for N-[1-(4-bromophenyl)propan-2-yl]-5-hydroxypyridine-3-carboxamide is CC(Cc1ccc(Br)cc1)NC(=O)c1cncc(O)c1.
What is the InChIKey of N-[1-(4-bromophenyl)propan-2-yl]-5-hydroxypyridine-3-carboxamide?
The InChIKey is AACGCJLTZWFHAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2O2/c1-10(6-11-2-4-13(16)5-3-11)18-15(20)12-7-14(19)9-17-8-12/h2-5,7-10,19H,6H2,1H3,(H,18,20).
What are the key properties of N-[1-(4-bromophenyl)propan-2-yl]-5-hydroxypyridine-3-carboxamide?
N-[1-(4-bromophenyl)propan-2-yl]-5-hydroxypyridine-3-carboxamide has a molecular weight of 335.20 g/mol, XLogP of 2.91, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-bromophenyl)propan-2-yl]-5-hydroxypyridine-3-carboxamide is sourced from PubChem (CID 63860266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).