6-amino-3-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide

C13H20ClN3O2 — CID 62161041

IUPAC6-amino-3-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide
SMILESCOCCN(CC(C)C)C(=O)c1nc(N)ccc1Cl
InChIInChI=1S/C13H20ClN3O2/c1-9(2)8-17(6-7-19-3)13(18)12-10(14)4-5-11(15)16-12/h4-5,9H,6-8H2,1-3H3,(H2,15,16)
InChIKeyANELKQMSJIHMMU-UHFFFAOYSA-N
MW285.78 g/mol
LogP2.06
Rot. Bonds6

About 6-amino-3-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide

6-amino-3-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide (PubChem CID 62161041) has the molecular formula C13H20ClN3O2 and a molecular weight of 285.78 g/mol. Its IUPAC name is 6-amino-3-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-amino-3-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide
PubChem CID62161041
Molecular FormulaC13H20ClN3O2
Molecular Weight285.78 g/mol
Exact Mass285.12
IUPAC Name6-amino-3-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide
SMILESCOCCN(CC(C)C)C(=O)c1nc(N)ccc1Cl
InChIInChI=1S/C13H20ClN3O2/c1-9(2)8-17(6-7-19-3)13(18)12-10(14)4-5-11(15)16-12/h4-5,9H,6-8H2,1-3H3,(H2,15,16)
InChIKeyANELKQMSJIHMMU-UHFFFAOYSA-N
XLogP2.06
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.78
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-amino-3-chloro-N,N-bis(2-methoxyethyl)pyridine-2-carboxamide
CID 55042057
6-amino-3-chloro-N-ethyl-N-(2-methylpropyl)pyridine-2-carboxamide
CID 62153910
3,6-dichloro-N,N-bis(2-methylpropyl)pyridine-2-carboxamide
CID 60748160
2-amino-5-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide
CID 114922590
6-amino-N,N-dibutyl-3-chloropyridine-2-carboxamide
CID 55042068
6-amino-3-chloro-N-(2-methylpropyl)pyridine-2-carboxamide
CID 62156560
6-amino-N-butan-2-yl-3-chloro-N-ethylpyridine-2-carboxamide
CID 62154764
6-amino-3-chloro-N-(2-hydroxyethyl)-N-propan-2-ylpyridine-2-carboxamide
CID 62186020
6-amino-3-chloro-N-[2-(dimethylamino)ethyl]-N-propylpyridine-2-carboxamide
CID 62161613
3-chloro-6-[2-methoxyethyl(2-methylpropyl)amino]pyridine-2-carboxylic acid
CID 54986470
6-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 113323490
3-amino-N-(2-methoxyethyl)-2-methyl-N-(2-methylpropyl)benzamide
CID 61105794

Frequently Asked Questions

What is the IUPAC name of 6-amino-3-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide?
The IUPAC name of 6-amino-3-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide (CID 62161041) is 6-amino-3-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-amino-3-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide?
The canonical SMILES for 6-amino-3-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide is COCCN(CC(C)C)C(=O)c1nc(N)ccc1Cl.
What is the InChIKey of 6-amino-3-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide?
The InChIKey is ANELKQMSJIHMMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20ClN3O2/c1-9(2)8-17(6-7-19-3)13(18)12-10(14)4-5-11(15)16-12/h4-5,9H,6-8H2,1-3H3,(H2,15,16).
What are the key properties of 6-amino-3-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide?
6-amino-3-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide has a molecular weight of 285.78 g/mol, XLogP of 2.06, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide is sourced from PubChem (CID 62161041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).