2-amino-N-ethyl-6-methyl-N-(2-methylpropyl)pyridine-4-carboxamide

C13H21N3O — CID 113378994

IUPAC2-amino-N-ethyl-6-methyl-N-(2-methylpropyl)pyridine-4-carboxamide
SMILESCCN(CC(C)C)C(=O)c1cc(C)nc(N)c1
InChIInChI=1S/C13H21N3O/c1-5-16(8-9(2)3)13(17)11-6-10(4)15-12(14)7-11/h6-7,9H,5,8H2,1-4H3,(H2,14,15)
InChIKeySHEPOPXGEVJPSQ-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.09
Rot. Bonds4

About 2-amino-N-ethyl-6-methyl-N-(2-methylpropyl)pyridine-4-carboxamide

2-amino-N-ethyl-6-methyl-N-(2-methylpropyl)pyridine-4-carboxamide (PubChem CID 113378994) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-amino-N-ethyl-6-methyl-N-(2-methylpropyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-ethyl-6-methyl-N-(2-methylpropyl)pyridine-4-carboxamide
PubChem CID113378994
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name2-amino-N-ethyl-6-methyl-N-(2-methylpropyl)pyridine-4-carboxamide
SMILESCCN(CC(C)C)C(=O)c1cc(C)nc(N)c1
InChIInChI=1S/C13H21N3O/c1-5-16(8-9(2)3)13(17)11-6-10(4)15-12(14)7-11/h6-7,9H,5,8H2,1-4H3,(H2,14,15)
InChIKeySHEPOPXGEVJPSQ-UHFFFAOYSA-N
XLogP2.09
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-ethyl-N-(2-methylpropyl)benzamide;hydrochloride
CID 119732301
N-ethyl-3-methyl-N-(2-methylpropyl)-5-sulfamoylbenzamide
CID 65388918
2-amino-6-chloro-N-(2-cyanoethyl)-N-(2-methylpropyl)pyridine-4-carboxamide
CID 62162054
2-amino-N-ethyl-N-(2-methylpropyl)-1,3-thiazole-4-carboxamide
CID 62788372
2-amino-6-methyl-N-(3-methyl-2-propan-2-ylbutyl)pyridine-4-carboxamide
CID 102908018
6-amino-3-chloro-N-ethyl-N-(2-methylpropyl)pyridine-2-carboxamide
CID 62153910
5-amino-N-ethyl-2-methyl-N-(2-methylpropyl)pyridine-3-carboxamide
CID 61040071
4-[ethyl(2-methylpropyl)carbamoyl]benzoic acid
CID 43452953
4-amino-3,5-difluoro-N,N-bis(2-methylpropyl)benzamide
CID 63185021
3,5-diamino-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)benzamide
CID 61116865
N-ethyl-2-fluoro-N-(2-methylpropyl)pyridine-4-carboxamide
CID 61293621
ethyl 2-[(3,5-diaminobenzoyl)-(2-methylpropyl)amino]acetate
CID 61105851

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-ethyl-6-methyl-N-(2-methylpropyl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-N-ethyl-6-methyl-N-(2-methylpropyl)pyridine-4-carboxamide (CID 113378994) is 2-amino-N-ethyl-6-methyl-N-(2-methylpropyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-ethyl-6-methyl-N-(2-methylpropyl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-ethyl-6-methyl-N-(2-methylpropyl)pyridine-4-carboxamide is CCN(CC(C)C)C(=O)c1cc(C)nc(N)c1.
What is the InChIKey of 2-amino-N-ethyl-6-methyl-N-(2-methylpropyl)pyridine-4-carboxamide?
The InChIKey is SHEPOPXGEVJPSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-5-16(8-9(2)3)13(17)11-6-10(4)15-12(14)7-11/h6-7,9H,5,8H2,1-4H3,(H2,14,15).
What are the key properties of 2-amino-N-ethyl-6-methyl-N-(2-methylpropyl)pyridine-4-carboxamide?
2-amino-N-ethyl-6-methyl-N-(2-methylpropyl)pyridine-4-carboxamide has a molecular weight of 235.33 g/mol, XLogP of 2.09, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethyl-6-methyl-N-(2-methylpropyl)pyridine-4-carboxamide is sourced from PubChem (CID 113378994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).