6-amino-3-chloro-N-ethyl-N-methylpyridine-2-carboxamide

C9H12ClN3O — CID 62154422

IUPAC6-amino-3-chloro-N-ethyl-N-methylpyridine-2-carboxamide
SMILESCCN(C)C(=O)c1nc(N)ccc1Cl
InChIInChI=1S/C9H12ClN3O/c1-3-13(2)9(14)8-6(10)4-5-7(11)12-8/h4-5H,3H2,1-2H3,(H2,11,12)
InChIKeyWLUHDDAABKJWCA-UHFFFAOYSA-N
MW213.67 g/mol
LogP1.41
Rot. Bonds2

About 6-amino-3-chloro-N-ethyl-N-methylpyridine-2-carboxamide

6-amino-3-chloro-N-ethyl-N-methylpyridine-2-carboxamide (PubChem CID 62154422) has the molecular formula C9H12ClN3O and a molecular weight of 213.67 g/mol. Its IUPAC name is 6-amino-3-chloro-N-ethyl-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name6-amino-3-chloro-N-ethyl-N-methylpyridine-2-carboxamide
PubChem CID62154422
Molecular FormulaC9H12ClN3O
Molecular Weight213.67 g/mol
Exact Mass213.07
IUPAC Name6-amino-3-chloro-N-ethyl-N-methylpyridine-2-carboxamide
SMILESCCN(C)C(=O)c1nc(N)ccc1Cl
InChIInChI=1S/C9H12ClN3O/c1-3-13(2)9(14)8-6(10)4-5-7(11)12-8/h4-5H,3H2,1-2H3,(H2,11,12)
InChIKeyWLUHDDAABKJWCA-UHFFFAOYSA-N
XLogP1.41
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.67
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-amino-3-chloro-N-ethyl-N-methylpyridine-2-carboxamide?
The IUPAC name of 6-amino-3-chloro-N-ethyl-N-methylpyridine-2-carboxamide (CID 62154422) is 6-amino-3-chloro-N-ethyl-N-methylpyridine-2-carboxamide.
What is the SMILES notation for 6-amino-3-chloro-N-ethyl-N-methylpyridine-2-carboxamide?
The canonical SMILES for 6-amino-3-chloro-N-ethyl-N-methylpyridine-2-carboxamide is CCN(C)C(=O)c1nc(N)ccc1Cl.
What is the InChIKey of 6-amino-3-chloro-N-ethyl-N-methylpyridine-2-carboxamide?
The InChIKey is WLUHDDAABKJWCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12ClN3O/c1-3-13(2)9(14)8-6(10)4-5-7(11)12-8/h4-5H,3H2,1-2H3,(H2,11,12).
What are the key properties of 6-amino-3-chloro-N-ethyl-N-methylpyridine-2-carboxamide?
6-amino-3-chloro-N-ethyl-N-methylpyridine-2-carboxamide has a molecular weight of 213.67 g/mol, XLogP of 1.41, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3-chloro-N-ethyl-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 62154422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).