5-(tert-butylamino)-N,N-diethylpyridine-3-carboxamide

C14H23N3O — CID 109238760

IUPAC5-(tert-butylamino)-N,N-diethylpyridine-3-carboxamide
SMILESCCN(CC)C(=O)c1cncc(NC(C)(C)C)c1
InChIInChI=1S/C14H23N3O/c1-6-17(7-2)13(18)11-8-12(10-15-9-11)16-14(3,4)5/h8-10,16H,6-7H2,1-5H3
InChIKeyYMVOTMKOWJYJLO-UHFFFAOYSA-N
MW249.36 g/mol
LogP2.77
Rot. Bonds4

About 5-(tert-butylamino)-N,N-diethylpyridine-3-carboxamide

5-(tert-butylamino)-N,N-diethylpyridine-3-carboxamide (PubChem CID 109238760) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 5-(tert-butylamino)-N,N-diethylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-(tert-butylamino)-N,N-diethylpyridine-3-carboxamide
PubChem CID109238760
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name5-(tert-butylamino)-N,N-diethylpyridine-3-carboxamide
SMILESCCN(CC)C(=O)c1cncc(NC(C)(C)C)c1
InChIInChI=1S/C14H23N3O/c1-6-17(7-2)13(18)11-8-12(10-15-9-11)16-14(3,4)5/h8-10,16H,6-7H2,1-5H3
InChIKeyYMVOTMKOWJYJLO-UHFFFAOYSA-N
XLogP2.77
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2-tert-butylanilino)-N,N-diethylpyridine-3-carboxamide
CID 109238796
ethyl 5-(tert-butylamino)pyridine-3-carboxylate
CID 82535159
N,N-diethyl-5-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109238757
5-(tert-butylamino)-N-[4-(diethylamino)phenyl]pyridine-3-carboxamide
CID 109239451
N-butan-2-yl-5-(tert-butylamino)pyridine-3-carboxamide
CID 109225186
5-(2,3-dimethylanilino)-N,N-diethylpyridine-3-carboxamide
CID 109238786
N,N-diethyl-5-(2-methoxyanilino)pyridine-3-carboxamide
CID 109238813
N,N-diethyl-5-(4-phenoxyanilino)pyridine-3-carboxamide
CID 109238844
5-(butylamino)-N,N-dipropylpyridine-3-carboxamide
CID 109224616
N-benzyl-5-(4-tert-butylanilino)-N-ethylpyridine-3-carboxamide
CID 109234765
3-N-(3-acetylphenyl)-5-N,5-N-diethylpyridine-3,5-dicarboxamide
CID 109106794
5-(tert-butylamino)-N-phenylpyridine-3-carboxamide
CID 109239388

Frequently Asked Questions

What is the IUPAC name of 5-(tert-butylamino)-N,N-diethylpyridine-3-carboxamide?
The IUPAC name of 5-(tert-butylamino)-N,N-diethylpyridine-3-carboxamide (CID 109238760) is 5-(tert-butylamino)-N,N-diethylpyridine-3-carboxamide.
What is the SMILES notation for 5-(tert-butylamino)-N,N-diethylpyridine-3-carboxamide?
The canonical SMILES for 5-(tert-butylamino)-N,N-diethylpyridine-3-carboxamide is CCN(CC)C(=O)c1cncc(NC(C)(C)C)c1.
What is the InChIKey of 5-(tert-butylamino)-N,N-diethylpyridine-3-carboxamide?
The InChIKey is YMVOTMKOWJYJLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-6-17(7-2)13(18)11-8-12(10-15-9-11)16-14(3,4)5/h8-10,16H,6-7H2,1-5H3.
What are the key properties of 5-(tert-butylamino)-N,N-diethylpyridine-3-carboxamide?
5-(tert-butylamino)-N,N-diethylpyridine-3-carboxamide has a molecular weight of 249.36 g/mol, XLogP of 2.77, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(tert-butylamino)-N,N-diethylpyridine-3-carboxamide is sourced from PubChem (CID 109238760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).