N-[4-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]-2-methylphenyl]acetamide

C16H19N3O2 — CID 78964135

IUPACN-[4-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]-2-methylphenyl]acetamide
SMILESCC(=O)Nc1ccc(NCc2nc(C)ccc2O)cc1C
InChIInChI=1S/C16H19N3O2/c1-10-8-13(5-6-14(10)19-12(3)20)17-9-15-16(21)7-4-11(2)18-15/h4-8,17,21H,9H2,1-3H3,(H,19,20)
InChIKeyAHNSWEUOGQSSMQ-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.97
Rot. Bonds4

About N-[4-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]-2-methylphenyl]acetamide

N-[4-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]-2-methylphenyl]acetamide (PubChem CID 78964135) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-[4-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]-2-methylphenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]-2-methylphenyl]acetamide
PubChem CID78964135
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN-[4-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]-2-methylphenyl]acetamide
SMILESCC(=O)Nc1ccc(NCc2nc(C)ccc2O)cc1C
InChIInChI=1S/C16H19N3O2/c1-10-8-13(5-6-14(10)19-12(3)20)17-9-15-16(21)7-4-11(2)18-15/h4-8,17,21H,9H2,1-3H3,(H,19,20)
InChIKeyAHNSWEUOGQSSMQ-UHFFFAOYSA-N
XLogP2.97
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-2-[(3-methyl-4-nitroanilino)methyl]pyridin-3-ol
CID 79150682
2-[(3,4-difluoroanilino)methyl]-6-methylpyridin-3-ol
CID 79163518
N-[2-methyl-4-(pyrimidin-5-ylmethylamino)phenyl]acetamide
CID 62758402
N-[2-methyl-4-(thiadiazol-4-ylmethylamino)phenyl]acetamide
CID 43672907
2-[[(6-chloro-5-methyl-3-pyridinyl)amino]methyl]-6-methylpyridin-3-ol
CID 103934398
2-[(4-bromo-3-methoxyanilino)methyl]-6-methylpyridin-3-ol
CID 79479389
N-[2-methyl-4-(2-methylpropylamino)phenyl]acetamide
CID 43672835
N-[4-[(5-fluoro-2-methylphenyl)methylamino]-2-methylphenyl]acetamide
CID 103943723
N-[4-[(3-bromo-4-methylphenyl)methylamino]-2-methylphenyl]acetamide
CID 115876095
2-[4-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]phenoxy]acetamide
CID 79156737
N-[4-[(2-ethylpyrazol-3-yl)methylamino]-2-methylphenyl]acetamide
CID 115761962
tert-butyl N-(4-acetamido-3-methylphenyl)carbamate
CID 65142696

Frequently Asked Questions

What is the IUPAC name of N-[4-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]-2-methylphenyl]acetamide?
The IUPAC name of N-[4-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]-2-methylphenyl]acetamide (CID 78964135) is N-[4-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]-2-methylphenyl]acetamide.
What is the SMILES notation for N-[4-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]-2-methylphenyl]acetamide?
The canonical SMILES for N-[4-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]-2-methylphenyl]acetamide is CC(=O)Nc1ccc(NCc2nc(C)ccc2O)cc1C.
What is the InChIKey of N-[4-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]-2-methylphenyl]acetamide?
The InChIKey is AHNSWEUOGQSSMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-10-8-13(5-6-14(10)19-12(3)20)17-9-15-16(21)7-4-11(2)18-15/h4-8,17,21H,9H2,1-3H3,(H,19,20).
What are the key properties of N-[4-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]-2-methylphenyl]acetamide?
N-[4-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]-2-methylphenyl]acetamide has a molecular weight of 285.35 g/mol, XLogP of 2.97, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(3-hydroxy-6-methyl-2-pyridinyl)methylamino]-2-methylphenyl]acetamide is sourced from PubChem (CID 78964135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).