5-amino-2-methyl-N-[2-(oxolan-2-yl)ethyl]pyridine-3-carboxamide

C13H19N3O2 — CID 61126144

IUPAC5-amino-2-methyl-N-[2-(oxolan-2-yl)ethyl]pyridine-3-carboxamide
SMILESCc1ncc(N)cc1C(=O)NCCC1CCCO1
InChIInChI=1S/C13H19N3O2/c1-9-12(7-10(14)8-16-9)13(17)15-5-4-11-3-2-6-18-11/h7-8,11H,2-6,14H2,1H3,(H,15,17)
InChIKeyTXVFFENNDCJEMX-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.27
Rot. Bonds4

About 5-amino-2-methyl-N-[2-(oxolan-2-yl)ethyl]pyridine-3-carboxamide

5-amino-2-methyl-N-[2-(oxolan-2-yl)ethyl]pyridine-3-carboxamide (PubChem CID 61126144) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 5-amino-2-methyl-N-[2-(oxolan-2-yl)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-amino-2-methyl-N-[2-(oxolan-2-yl)ethyl]pyridine-3-carboxamide
PubChem CID61126144
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name5-amino-2-methyl-N-[2-(oxolan-2-yl)ethyl]pyridine-3-carboxamide
SMILESCc1ncc(N)cc1C(=O)NCCC1CCCO1
InChIInChI=1S/C13H19N3O2/c1-9-12(7-10(14)8-16-9)13(17)15-5-4-11-3-2-6-18-11/h7-8,11H,2-6,14H2,1H3,(H,15,17)
InChIKeyTXVFFENNDCJEMX-UHFFFAOYSA-N
XLogP1.27
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

oxolan-2-ylmethyl 5-amino-2-methylpyridine-3-carboxylate
CID 61310245
3-amino-4-methyl-N-[2-(oxolan-2-yl)ethyl]benzamide
CID 54915859
3-amino-N-[2-(oxolan-2-yl)ethyl]benzamide
CID 54915842
5-amino-N-[2-(azepan-1-yl)ethyl]-2-methylpyridine-3-carboxamide
CID 61241531
3-hydroxy-N-[2-(oxolan-2-yl)ethyl]pyridine-4-carboxamide
CID 80707090
6-(ethylamino)-N-[2-(oxolan-2-yl)ethyl]pyridine-3-carboxamide
CID 62176089
4-amino-N-[2-(oxan-2-yl)ethyl]benzamide
CID 83633238
6-amino-N-[2-(oxolan-2-yl)ethyl]-1H-indole-3-carboxamide
CID 61126926
2-methyl-N-[2-[(2S)-oxolan-2-yl]ethyl]-6-phenylpyridine-3-carboxamide
CID 97002216
5-amino-2-methyl-N-(3-piperidin-1-ylpropyl)pyridine-3-carboxamide
CID 61118452
2-amino-6-chloro-N-[2-(oxolan-2-yl)ethyl]pyridine-4-carboxamide
CID 55042052
4-amino-6-methyl-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 81236449

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-methyl-N-[2-(oxolan-2-yl)ethyl]pyridine-3-carboxamide?
The IUPAC name of 5-amino-2-methyl-N-[2-(oxolan-2-yl)ethyl]pyridine-3-carboxamide (CID 61126144) is 5-amino-2-methyl-N-[2-(oxolan-2-yl)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-amino-2-methyl-N-[2-(oxolan-2-yl)ethyl]pyridine-3-carboxamide?
The canonical SMILES for 5-amino-2-methyl-N-[2-(oxolan-2-yl)ethyl]pyridine-3-carboxamide is Cc1ncc(N)cc1C(=O)NCCC1CCCO1.
What is the InChIKey of 5-amino-2-methyl-N-[2-(oxolan-2-yl)ethyl]pyridine-3-carboxamide?
The InChIKey is TXVFFENNDCJEMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-9-12(7-10(14)8-16-9)13(17)15-5-4-11-3-2-6-18-11/h7-8,11H,2-6,14H2,1H3,(H,15,17).
What are the key properties of 5-amino-2-methyl-N-[2-(oxolan-2-yl)ethyl]pyridine-3-carboxamide?
5-amino-2-methyl-N-[2-(oxolan-2-yl)ethyl]pyridine-3-carboxamide has a molecular weight of 249.31 g/mol, XLogP of 1.27, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-methyl-N-[2-(oxolan-2-yl)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 61126144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).