N-[2-(1-aminoethyl)phenyl]-3-hydroxypyridine-4-carboxamide

C14H15N3O2 — CID 81445316

IUPACN-[2-(1-aminoethyl)phenyl]-3-hydroxypyridine-4-carboxamide
SMILESCC(N)c1ccccc1NC(=O)c1ccncc1O
InChIInChI=1S/C14H15N3O2/c1-9(15)10-4-2-3-5-12(10)17-14(19)11-6-7-16-8-13(11)18/h2-9,18H,15H2,1H3,(H,17,19)
InChIKeyVRLVJDSIXVJBTF-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.06
Rot. Bonds3

About N-[2-(1-aminoethyl)phenyl]-3-hydroxypyridine-4-carboxamide

N-[2-(1-aminoethyl)phenyl]-3-hydroxypyridine-4-carboxamide (PubChem CID 81445316) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is N-[2-(1-aminoethyl)phenyl]-3-hydroxypyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(1-aminoethyl)phenyl]-3-hydroxypyridine-4-carboxamide
PubChem CID81445316
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC NameN-[2-(1-aminoethyl)phenyl]-3-hydroxypyridine-4-carboxamide
SMILESCC(N)c1ccccc1NC(=O)c1ccncc1O
InChIInChI=1S/C14H15N3O2/c1-9(15)10-4-2-3-5-12(10)17-14(19)11-6-7-16-8-13(11)18/h2-9,18H,15H2,1H3,(H,17,19)
InChIKeyVRLVJDSIXVJBTF-UHFFFAOYSA-N
XLogP2.06
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-acetylphenyl)-3-hydroxypyridine-4-carboxamide
CID 81446255
N-(2-chlorophenyl)-3-hydroxypyridine-4-carboxamide
CID 81443413
3-hydroxy-N-naphthalen-1-ylpyridine-4-carboxamide
CID 81443161
3-hydroxy-N-(3-iodo-2-methylphenyl)pyridine-4-carboxamide
CID 114256881
N-(2-chloro-3-methylphenyl)-3-hydroxypyridine-4-carboxamide
CID 114251337
N-(2,3-dichlorophenyl)-3-hydroxypyridine-4-carboxamide
CID 81443246
2-hydroxy-N-[2-(1-hydroxyethyl)phenyl]benzamide
CID 43508470
N-(2-amino-4,5-dimethylphenyl)-3-hydroxypyridine-4-carboxamide
CID 81446459
N-[2-(1-aminoethyl)phenyl]-2-fluoro-6-hydroxybenzamide
CID 107014627
3-[2-[(3-hydroxypyridine-4-carbonyl)amino]phenyl]propanoic acid
CID 107272392
N-[2-(1-bromoethyl)phenyl]-2-hydroxybenzamide
CID 114315539
N-[2-(1-aminoethyl)phenyl]-2-methylpyrazole-3-carboxamide
CID 62918927

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-aminoethyl)phenyl]-3-hydroxypyridine-4-carboxamide?
The IUPAC name of N-[2-(1-aminoethyl)phenyl]-3-hydroxypyridine-4-carboxamide (CID 81445316) is N-[2-(1-aminoethyl)phenyl]-3-hydroxypyridine-4-carboxamide.
What is the SMILES notation for N-[2-(1-aminoethyl)phenyl]-3-hydroxypyridine-4-carboxamide?
The canonical SMILES for N-[2-(1-aminoethyl)phenyl]-3-hydroxypyridine-4-carboxamide is CC(N)c1ccccc1NC(=O)c1ccncc1O.
What is the InChIKey of N-[2-(1-aminoethyl)phenyl]-3-hydroxypyridine-4-carboxamide?
The InChIKey is VRLVJDSIXVJBTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-9(15)10-4-2-3-5-12(10)17-14(19)11-6-7-16-8-13(11)18/h2-9,18H,15H2,1H3,(H,17,19).
What are the key properties of N-[2-(1-aminoethyl)phenyl]-3-hydroxypyridine-4-carboxamide?
N-[2-(1-aminoethyl)phenyl]-3-hydroxypyridine-4-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 2.06, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-aminoethyl)phenyl]-3-hydroxypyridine-4-carboxamide is sourced from PubChem (CID 81445316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).