3-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridine-2-carboxamide

C13H21N3O3 — CID 104742102

IUPAC3-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridine-2-carboxamide
SMILESCOCCN(C(=O)c1ncccc1N)C(C)COC
InChIInChI=1S/C13H21N3O3/c1-10(9-19-3)16(7-8-18-2)13(17)12-11(14)5-4-6-15-12/h4-6,10H,7-9,14H2,1-3H3
InChIKeyKFWUUMQDIGDYJN-UHFFFAOYSA-N
MW267.33 g/mol
LogP0.79
Rot. Bonds7

About 3-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridine-2-carboxamide

3-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridine-2-carboxamide (PubChem CID 104742102) has the molecular formula C13H21N3O3 and a molecular weight of 267.33 g/mol. Its IUPAC name is 3-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridine-2-carboxamide
PubChem CID104742102
Molecular FormulaC13H21N3O3
Molecular Weight267.33 g/mol
Exact Mass267.16
IUPAC Name3-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridine-2-carboxamide
SMILESCOCCN(C(=O)c1ncccc1N)C(C)COC
InChIInChI=1S/C13H21N3O3/c1-10(9-19-3)16(7-8-18-2)13(17)12-11(14)5-4-6-15-12/h4-6,10H,7-9,14H2,1-3H3
InChIKeyKFWUUMQDIGDYJN-UHFFFAOYSA-N
XLogP0.79
TPSA77.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-N-butan-2-yl-N-butylpyridine-2-carboxamide
CID 113447633
3-amino-N-butan-2-yl-N-ethylpyridine-2-carboxamide
CID 104741017
2-amino-6-chloro-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)benzamide
CID 63659332
6-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridine-3-carboxamide
CID 62187168
3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 104740778
3-amino-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 104740997
2-[[2-methoxyethyl(1-methoxypropan-2-yl)amino]methyl]pyridin-3-amine
CID 104739958
3-hydroxy-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridine-4-carboxamide
CID 81443763
2-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-methylbenzamide
CID 62508733
3-amino-N-(4-methoxybutyl)pyridine-2-carboxamide
CID 104742127
3-amino-N-ethyl-N-propylpyridine-2-carboxamide
CID 104741010
3-amino-N-[2-(3-methoxypropylamino)-2-oxoethyl]-N-methylpyridine-2-carboxamide
CID 104741760

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridine-2-carboxamide (CID 104742102) is 3-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridine-2-carboxamide is COCCN(C(=O)c1ncccc1N)C(C)COC.
What is the InChIKey of 3-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridine-2-carboxamide?
The InChIKey is KFWUUMQDIGDYJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O3/c1-10(9-19-3)16(7-8-18-2)13(17)12-11(14)5-4-6-15-12/h4-6,10H,7-9,14H2,1-3H3.
What are the key properties of 3-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridine-2-carboxamide?
3-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridine-2-carboxamide has a molecular weight of 267.33 g/mol, XLogP of 0.79, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 104742102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).