2-amino-N-(3,3-dimethylbutan-2-yl)-6-ethylpyridine-4-carboxamide

C14H23N3O — CID 113458047

IUPAC2-amino-N-(3,3-dimethylbutan-2-yl)-6-ethylpyridine-4-carboxamide
SMILESCCc1cc(C(=O)NC(C)C(C)(C)C)cc(N)n1
InChIInChI=1S/C14H23N3O/c1-6-11-7-10(8-12(15)17-11)13(18)16-9(2)14(3,4)5/h7-9H,6H2,1-5H3,(H2,15,17)(H,16,18)
InChIKeyRWFPCYVLIVSREL-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.39
Rot. Bonds3

About 2-amino-N-(3,3-dimethylbutan-2-yl)-6-ethylpyridine-4-carboxamide

2-amino-N-(3,3-dimethylbutan-2-yl)-6-ethylpyridine-4-carboxamide (PubChem CID 113458047) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 2-amino-N-(3,3-dimethylbutan-2-yl)-6-ethylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(3,3-dimethylbutan-2-yl)-6-ethylpyridine-4-carboxamide
PubChem CID113458047
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name2-amino-N-(3,3-dimethylbutan-2-yl)-6-ethylpyridine-4-carboxamide
SMILESCCc1cc(C(=O)NC(C)C(C)(C)C)cc(N)n1
InChIInChI=1S/C14H23N3O/c1-6-11-7-10(8-12(15)17-11)13(18)16-9(2)14(3,4)5/h7-9H,6H2,1-5H3,(H2,15,17)(H,16,18)
InChIKeyRWFPCYVLIVSREL-UHFFFAOYSA-N
XLogP2.39
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)-6-ethylpyridine-4-carboxamide
CID 106347161
2-amino-6-ethyl-N-(1-methylsulfinylpropan-2-yl)pyridine-4-carboxamide
CID 113486728
2-amino-N-(cyclopentylmethyl)-6-ethylpyridine-4-carboxamide
CID 113380993
2-(3,3-dimethylbutan-2-ylamino)-6-ethylpyridine-4-carboxylic acid
CID 113457836
N-(1-amino-3-methyl-1-oxobutan-2-yl)-2-ethyl-6-(ethylamino)pyridine-4-carboxamide
CID 106347132
2-amino-6-chloro-N-(2-methylpentan-3-yl)pyridine-4-carboxamide
CID 62160387
2-amino-N-(3-methylpentan-3-yl)-6-propylpyridine-4-carboxamide
CID 106331239
3-bromo-N-(3,3-dimethylbutan-2-yl)-5-methylbenzamide
CID 104853017
2-amino-N-butan-2-yl-6-chloropyridine-4-carboxamide
CID 62155359
2-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)-6-tert-butylpyridine-4-carboxamide
CID 106347146
2-amino-N-(2-bromo-5-fluorophenyl)-6-ethylpyridine-4-carboxamide
CID 107631716
3-bromo-N-(3,3-dimethylbutan-2-yl)benzamide
CID 3434311

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3,3-dimethylbutan-2-yl)-6-ethylpyridine-4-carboxamide?
The IUPAC name of 2-amino-N-(3,3-dimethylbutan-2-yl)-6-ethylpyridine-4-carboxamide (CID 113458047) is 2-amino-N-(3,3-dimethylbutan-2-yl)-6-ethylpyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-(3,3-dimethylbutan-2-yl)-6-ethylpyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-(3,3-dimethylbutan-2-yl)-6-ethylpyridine-4-carboxamide is CCc1cc(C(=O)NC(C)C(C)(C)C)cc(N)n1.
What is the InChIKey of 2-amino-N-(3,3-dimethylbutan-2-yl)-6-ethylpyridine-4-carboxamide?
The InChIKey is RWFPCYVLIVSREL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-6-11-7-10(8-12(15)17-11)13(18)16-9(2)14(3,4)5/h7-9H,6H2,1-5H3,(H2,15,17)(H,16,18).
What are the key properties of 2-amino-N-(3,3-dimethylbutan-2-yl)-6-ethylpyridine-4-carboxamide?
2-amino-N-(3,3-dimethylbutan-2-yl)-6-ethylpyridine-4-carboxamide has a molecular weight of 249.36 g/mol, XLogP of 2.39, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3,3-dimethylbutan-2-yl)-6-ethylpyridine-4-carboxamide is sourced from PubChem (CID 113458047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).