6-methyl-4-(methylamino)-N-pentan-2-ylpyridine-3-carboxamide

C13H21N3O — CID 81234798

IUPAC6-methyl-4-(methylamino)-N-pentan-2-ylpyridine-3-carboxamide
SMILESCCCC(C)NC(=O)c1cnc(C)cc1NC
InChIInChI=1S/C13H21N3O/c1-5-6-9(2)16-13(17)11-8-15-10(3)7-12(11)14-4/h7-9H,5-6H2,1-4H3,(H,14,15)(H,16,17)
InChIKeyKJDYQNCXESPALB-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.35
Rot. Bonds5

About 6-methyl-4-(methylamino)-N-pentan-2-ylpyridine-3-carboxamide

6-methyl-4-(methylamino)-N-pentan-2-ylpyridine-3-carboxamide (PubChem CID 81234798) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 6-methyl-4-(methylamino)-N-pentan-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-4-(methylamino)-N-pentan-2-ylpyridine-3-carboxamide
PubChem CID81234798
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name6-methyl-4-(methylamino)-N-pentan-2-ylpyridine-3-carboxamide
SMILESCCCC(C)NC(=O)c1cnc(C)cc1NC
InChIInChI=1S/C13H21N3O/c1-5-6-9(2)16-13(17)11-8-15-10(3)7-12(11)14-4/h7-9H,5-6H2,1-4H3,(H,14,15)(H,16,17)
InChIKeyKJDYQNCXESPALB-UHFFFAOYSA-N
XLogP2.35
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-4-(methylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 81236299
N-(1-methoxypropan-2-yl)-6-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81233584
N-(1-cyclopropylpropan-2-yl)-6-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81242031
N-[1-(4-chlorophenyl)ethyl]-6-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81237023
6-methyl-4-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-3-carboxamide
CID 106218085
6-methyl-N-[1-(methylamino)-1-oxopropan-2-yl]-4-(propylamino)pyridine-3-carboxamide
CID 81240178
2,4-dimethyl-N-[(2R)-pentan-2-yl]pyrimidine-5-carboxamide
CID 92648513
4-(ethylamino)-6-methyl-N-[1-(methylamino)-1-oxopropan-2-yl]pyridine-3-carboxamide
CID 81240001
4-amino-6-methyl-N-octan-2-ylpyridine-3-carboxamide
CID 81243070
N,N-diethyl-6-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81236532
5-amino-2-methyl-N-pentan-2-ylpyridine-3-carboxamide
CID 61040311
4-chloro-N-(4-hydroxybutan-2-yl)-6-methylpyridine-3-carboxamide
CID 115283582

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-(methylamino)-N-pentan-2-ylpyridine-3-carboxamide?
The IUPAC name of 6-methyl-4-(methylamino)-N-pentan-2-ylpyridine-3-carboxamide (CID 81234798) is 6-methyl-4-(methylamino)-N-pentan-2-ylpyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-4-(methylamino)-N-pentan-2-ylpyridine-3-carboxamide?
The canonical SMILES for 6-methyl-4-(methylamino)-N-pentan-2-ylpyridine-3-carboxamide is CCCC(C)NC(=O)c1cnc(C)cc1NC.
What is the InChIKey of 6-methyl-4-(methylamino)-N-pentan-2-ylpyridine-3-carboxamide?
The InChIKey is KJDYQNCXESPALB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-5-6-9(2)16-13(17)11-8-15-10(3)7-12(11)14-4/h7-9H,5-6H2,1-4H3,(H,14,15)(H,16,17).
What are the key properties of 6-methyl-4-(methylamino)-N-pentan-2-ylpyridine-3-carboxamide?
6-methyl-4-(methylamino)-N-pentan-2-ylpyridine-3-carboxamide has a molecular weight of 235.33 g/mol, XLogP of 2.35, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-(methylamino)-N-pentan-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 81234798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).