3-hydroxy-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide

C11H17N3O2 — CID 115302635

IUPAC3-hydroxy-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide
SMILESCNCC(C)CNC(=O)c1ncccc1O
InChIInChI=1S/C11H17N3O2/c1-8(6-12-2)7-14-11(16)10-9(15)4-3-5-13-10/h3-5,8,12,15H,6-7H2,1-2H3,(H,14,16)
InChIKeyNLYWTSWZKDYIJU-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.37
Rot. Bonds5

About 3-hydroxy-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide

3-hydroxy-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide (PubChem CID 115302635) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 3-hydroxy-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide
PubChem CID115302635
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name3-hydroxy-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide
SMILESCNCC(C)CNC(=O)c1ncccc1O
InChIInChI=1S/C11H17N3O2/c1-8(6-12-2)7-14-11(16)10-9(15)4-3-5-13-10/h3-5,8,12,15H,6-7H2,1-2H3,(H,14,16)
InChIKeyNLYWTSWZKDYIJU-UHFFFAOYSA-N
XLogP0.37
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide
CID 81479287
(2S)-2-hydroxy-3-[(3-hydroxypyridine-2-carbonyl)amino]propanoic acid
CID 107833697
3-hydroxy-N-(3-imidazol-1-yl-2-methylpropyl)pyridine-2-carboxamide
CID 91649854
3-hydroxy-N-[(2R)-2-pyrrolidin-1-ylpropyl]pyridine-2-carboxamide
CID 95284101
3-hydroxy-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-2-carboxamide
CID 54861412
3-hydroxy-N-[2-(2-hydroxypropylamino)ethyl]pyridine-2-carboxamide
CID 113430399
3-hydroxy-N-(2-hydroxy-2,4-dimethylpentyl)pyridine-2-carboxamide
CID 66179346
3-hydroxypyridine-2-carbohydrazide
CID 45083058
3-bromo-N-[(2S)-2-hydroxypropyl]pyridine-2-carboxamide
CID 107519736
3-hydroxy-N-(1-methylsulfinylpropan-2-yl)pyridine-2-carboxamide
CID 104508689
(2S)-2-[(3-hydroxypyridine-2-carbonyl)amino]propanoic acid
CID 59513093
2-methyl-N-[2-methyl-3-(methylamino)propyl]pyrazole-3-carboxamide
CID 81478587

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide?
The IUPAC name of 3-hydroxy-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide (CID 115302635) is 3-hydroxy-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide.
What is the SMILES notation for 3-hydroxy-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide?
The canonical SMILES for 3-hydroxy-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide is CNCC(C)CNC(=O)c1ncccc1O.
What is the InChIKey of 3-hydroxy-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide?
The InChIKey is NLYWTSWZKDYIJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-8(6-12-2)7-14-11(16)10-9(15)4-3-5-13-10/h3-5,8,12,15H,6-7H2,1-2H3,(H,14,16).
What are the key properties of 3-hydroxy-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide?
3-hydroxy-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide has a molecular weight of 223.28 g/mol, XLogP of 0.37, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide is sourced from PubChem (CID 115302635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).