N-(4-amino-2,5-dimethylphenyl)-3-hydroxypyridine-4-carboxamide

C14H15N3O2 — CID 103144448

IUPACN-(4-amino-2,5-dimethylphenyl)-3-hydroxypyridine-4-carboxamide
SMILESCc1cc(NC(=O)c2ccncc2O)c(C)cc1N
InChIInChI=1S/C14H15N3O2/c1-8-6-12(9(2)5-11(8)15)17-14(19)10-3-4-16-7-13(10)18/h3-7,18H,15H2,1-2H3,(H,17,19)
InChIKeyJOZSYIRKXQYNIJ-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.24
Rot. Bonds2

About N-(4-amino-2,5-dimethylphenyl)-3-hydroxypyridine-4-carboxamide

N-(4-amino-2,5-dimethylphenyl)-3-hydroxypyridine-4-carboxamide (PubChem CID 103144448) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is N-(4-amino-2,5-dimethylphenyl)-3-hydroxypyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-amino-2,5-dimethylphenyl)-3-hydroxypyridine-4-carboxamide
PubChem CID103144448
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC NameN-(4-amino-2,5-dimethylphenyl)-3-hydroxypyridine-4-carboxamide
SMILESCc1cc(NC(=O)c2ccncc2O)c(C)cc1N
InChIInChI=1S/C14H15N3O2/c1-8-6-12(9(2)5-11(8)15)17-14(19)10-3-4-16-7-13(10)18/h3-7,18H,15H2,1-2H3,(H,17,19)
InChIKeyJOZSYIRKXQYNIJ-UHFFFAOYSA-N
XLogP2.24
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(2-amino-4,5-dimethylphenyl)-3-hydroxypyridine-4-carboxamide
CID 81446459
N-(4-amino-2,5-dimethylphenyl)-3-hydroxy-2-methylbenzamide
CID 103144449
N-(2-amino-4-hydroxyphenyl)-3-hydroxypyridine-4-carboxamide
CID 107697250
N-(2-chloro-3-methylphenyl)-3-hydroxypyridine-4-carboxamide
CID 114251337
3-amino-4-[(3-hydroxypyridine-4-carbonyl)amino]benzoic acid
CID 81445608
N-(2,4-dibromophenyl)-3-hydroxypyridine-4-carboxamide
CID 81442512
N-(4-amino-2,5-dimethylphenyl)-2-hydroxy-5-methoxybenzamide
CID 103144431
N-(4-amino-2,5-dimethylphenyl)-4-bromo-2-methylbenzamide
CID 103144641
3-hydroxy-N-(3-iodo-2-methylphenyl)pyridine-4-carboxamide
CID 114256881
4-[(3-hydroxypyridine-4-carbonyl)amino]-2-methylbenzoic acid
CID 81445783
N-(3-amino-4-pyridinyl)-2,4-dimethylbenzamide
CID 63062252
3-hydroxy-N-(2-methoxy-5-methylphenyl)pyridine-4-carboxamide
CID 81442907

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2,5-dimethylphenyl)-3-hydroxypyridine-4-carboxamide?
The IUPAC name of N-(4-amino-2,5-dimethylphenyl)-3-hydroxypyridine-4-carboxamide (CID 103144448) is N-(4-amino-2,5-dimethylphenyl)-3-hydroxypyridine-4-carboxamide.
What is the SMILES notation for N-(4-amino-2,5-dimethylphenyl)-3-hydroxypyridine-4-carboxamide?
The canonical SMILES for N-(4-amino-2,5-dimethylphenyl)-3-hydroxypyridine-4-carboxamide is Cc1cc(NC(=O)c2ccncc2O)c(C)cc1N.
What is the InChIKey of N-(4-amino-2,5-dimethylphenyl)-3-hydroxypyridine-4-carboxamide?
The InChIKey is JOZSYIRKXQYNIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-8-6-12(9(2)5-11(8)15)17-14(19)10-3-4-16-7-13(10)18/h3-7,18H,15H2,1-2H3,(H,17,19).
What are the key properties of N-(4-amino-2,5-dimethylphenyl)-3-hydroxypyridine-4-carboxamide?
N-(4-amino-2,5-dimethylphenyl)-3-hydroxypyridine-4-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 2.24, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2,5-dimethylphenyl)-3-hydroxypyridine-4-carboxamide is sourced from PubChem (CID 103144448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).