3-chloro-N-methyl-6-(methylamino)-N-(4-methylpentan-2-yl)pyridine-2-carboxamide

C14H22ClN3O — CID 55046771

IUPAC3-chloro-N-methyl-6-(methylamino)-N-(4-methylpentan-2-yl)pyridine-2-carboxamide
SMILESCNc1ccc(Cl)c(C(=O)N(C)C(C)CC(C)C)n1
InChIInChI=1S/C14H22ClN3O/c1-9(2)8-10(3)18(5)14(19)13-11(15)6-7-12(16-4)17-13/h6-7,9-10H,8H2,1-5H3,(H,16,17)
InChIKeyDXWSPDVRTVKNRF-UHFFFAOYSA-N
MW283.80 g/mol
LogP3.28
Rot. Bonds5

About 3-chloro-N-methyl-6-(methylamino)-N-(4-methylpentan-2-yl)pyridine-2-carboxamide

3-chloro-N-methyl-6-(methylamino)-N-(4-methylpentan-2-yl)pyridine-2-carboxamide (PubChem CID 55046771) has the molecular formula C14H22ClN3O and a molecular weight of 283.80 g/mol. Its IUPAC name is 3-chloro-N-methyl-6-(methylamino)-N-(4-methylpentan-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-N-methyl-6-(methylamino)-N-(4-methylpentan-2-yl)pyridine-2-carboxamide
PubChem CID55046771
Molecular FormulaC14H22ClN3O
Molecular Weight283.80 g/mol
Exact Mass283.15
IUPAC Name3-chloro-N-methyl-6-(methylamino)-N-(4-methylpentan-2-yl)pyridine-2-carboxamide
SMILESCNc1ccc(Cl)c(C(=O)N(C)C(C)CC(C)C)n1
InChIInChI=1S/C14H22ClN3O/c1-9(2)8-10(3)18(5)14(19)13-11(15)6-7-12(16-4)17-13/h6-7,9-10H,8H2,1-5H3,(H,16,17)
InChIKeyDXWSPDVRTVKNRF-UHFFFAOYSA-N
XLogP3.28
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.80
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N,N-diethyl-6-(methylamino)pyridine-2-carboxamide
CID 62173042
3-chloro-N-(1-methoxypropan-2-yl)-N-methyl-6-(propylamino)pyridine-2-carboxamide
CID 62179080
3-chloro-N-methyl-6-(methylamino)-N-(2-methylsulfanylethyl)pyridine-2-carboxamide
CID 112664070
3-chloro-6-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-2-carboxamide
CID 106050247
3-chloro-N-methyl-6-(methylamino)-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide
CID 62169187
N-(2-acetamidoethyl)-3-chloro-6-(methylamino)pyridine-2-carboxamide
CID 62170062
3-chloro-6-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)pyridine-2-carboxamide
CID 112664408
3-chloro-N-(1-ethoxypropan-2-yl)-6-(methylamino)pyridine-2-carboxamide
CID 55047188
3-chloro-6-(methylamino)-N-(1-methylsulfanylpropan-2-yl)pyridine-2-carboxamide
CID 113473020
3,6-dichloro-N-[(2S)-1-cyanopropan-2-yl]-N-methylpyridine-2-carboxamide
CID 95034090
6-amino-3-chloro-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridine-2-carboxamide
CID 112664231
3-chloro-N-ethyl-N-(3-fluorophenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62179071

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-methyl-6-(methylamino)-N-(4-methylpentan-2-yl)pyridine-2-carboxamide?
The IUPAC name of 3-chloro-N-methyl-6-(methylamino)-N-(4-methylpentan-2-yl)pyridine-2-carboxamide (CID 55046771) is 3-chloro-N-methyl-6-(methylamino)-N-(4-methylpentan-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-N-methyl-6-(methylamino)-N-(4-methylpentan-2-yl)pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-N-methyl-6-(methylamino)-N-(4-methylpentan-2-yl)pyridine-2-carboxamide is CNc1ccc(Cl)c(C(=O)N(C)C(C)CC(C)C)n1.
What is the InChIKey of 3-chloro-N-methyl-6-(methylamino)-N-(4-methylpentan-2-yl)pyridine-2-carboxamide?
The InChIKey is DXWSPDVRTVKNRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22ClN3O/c1-9(2)8-10(3)18(5)14(19)13-11(15)6-7-12(16-4)17-13/h6-7,9-10H,8H2,1-5H3,(H,16,17).
What are the key properties of 3-chloro-N-methyl-6-(methylamino)-N-(4-methylpentan-2-yl)pyridine-2-carboxamide?
3-chloro-N-methyl-6-(methylamino)-N-(4-methylpentan-2-yl)pyridine-2-carboxamide has a molecular weight of 283.80 g/mol, XLogP of 3.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-methyl-6-(methylamino)-N-(4-methylpentan-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 55046771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).