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

C12H19N3O — CID 81479287

IUPAC3-methyl-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide
SMILESCNCC(C)CNC(=O)c1ncccc1C
InChIInChI=1S/C12H19N3O/c1-9(7-13-3)8-15-12(16)11-10(2)5-4-6-14-11/h4-6,9,13H,7-8H2,1-3H3,(H,15,16)
InChIKeyHBIHIXURJCYZAT-UHFFFAOYSA-N
MW221.30 g/mol
LogP0.98
Rot. Bonds5

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

3-methyl-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide (PubChem CID 81479287) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 3-methyl-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide
PubChem CID81479287
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name3-methyl-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide
SMILESCNCC(C)CNC(=O)c1ncccc1C
InChIInChI=1S/C12H19N3O/c1-9(7-13-3)8-15-12(16)11-10(2)5-4-6-14-11/h4-6,9,13H,7-8H2,1-3H3,(H,15,16)
InChIKeyHBIHIXURJCYZAT-UHFFFAOYSA-N
XLogP0.98
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-hydroxy-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide
CID 115302635
methyl 2-hydroxy-3-[(3-methylpyridine-2-carbonyl)amino]propanoate
CID 113358708
N-(2-chloro-4-methylpentyl)-3-methylpyridine-2-carboxamide
CID 107157408
N-(2-amino-2-phenylethyl)-3-methylpyridine-2-carboxamide
CID 55176966
N-(1-hydroxypropan-2-yl)-3-methylpyridine-2-carboxamide
CID 62341368
2-iodo-3-methyl-N-[2-methyl-3-(methylamino)propyl]benzamide
CID 113265693
N-(1-aminoethyl)-3-methylpyridine-2-carboxamide
CID 173067121
N-(4-hydroxybutan-2-yl)-3-methylpyridine-2-carboxamide
CID 115283439
N-(4-amino-4-hydroxyiminobutan-2-yl)-3-methylpyridine-2-carboxamide
CID 76940244
N-(4-aminobutan-2-yl)-3-methylpyridine-2-carboxamide
CID 62340960
4-methyl-N-[2-methyl-3-(methylamino)propyl]benzamide
CID 81479378
3-methyl-N-[2-methyl-3-(methylamino)propyl]furan-2-carboxamide
CID 81479014

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide?
The IUPAC name of 3-methyl-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide (CID 81479287) is 3-methyl-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide.
What is the SMILES notation for 3-methyl-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide?
The canonical SMILES for 3-methyl-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide is CNCC(C)CNC(=O)c1ncccc1C.
What is the InChIKey of 3-methyl-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide?
The InChIKey is HBIHIXURJCYZAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-9(7-13-3)8-15-12(16)11-10(2)5-4-6-14-11/h4-6,9,13H,7-8H2,1-3H3,(H,15,16).
What are the key properties of 3-methyl-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide?
3-methyl-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide has a molecular weight of 221.30 g/mol, XLogP of 0.98, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[2-methyl-3-(methylamino)propyl]pyridine-2-carboxamide is sourced from PubChem (CID 81479287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).