5-[butyl(methyl)amino]-N-phenylpyridine-3-carboxamide

C17H21N3O — CID 109240365

IUPAC5-[butyl(methyl)amino]-N-phenylpyridine-3-carboxamide
SMILESCCCCN(C)c1cncc(C(=O)Nc2ccccc2)c1
InChIInChI=1S/C17H21N3O/c1-3-4-10-20(2)16-11-14(12-18-13-16)17(21)19-15-8-6-5-7-9-15/h5-9,11-13H,3-4,10H2,1-2H3,(H,19,21)
InChIKeyUXQPPXGTSOPHQM-UHFFFAOYSA-N
MW283.38 g/mol
LogP3.57
Rot. Bonds6

About 5-[butyl(methyl)amino]-N-phenylpyridine-3-carboxamide

5-[butyl(methyl)amino]-N-phenylpyridine-3-carboxamide (PubChem CID 109240365) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is 5-[butyl(methyl)amino]-N-phenylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-[butyl(methyl)amino]-N-phenylpyridine-3-carboxamide
PubChem CID109240365
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC Name5-[butyl(methyl)amino]-N-phenylpyridine-3-carboxamide
SMILESCCCCN(C)c1cncc(C(=O)Nc2ccccc2)c1
InChIInChI=1S/C17H21N3O/c1-3-4-10-20(2)16-11-14(12-18-13-16)17(21)19-15-8-6-5-7-9-15/h5-9,11-13H,3-4,10H2,1-2H3,(H,19,21)
InChIKeyUXQPPXGTSOPHQM-UHFFFAOYSA-N
XLogP3.57
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[butyl(methyl)amino]-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109240367
5-[butyl(methyl)amino]-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 109240389
5-(dipropylamino)-N-phenylpyridine-3-carboxamide
CID 109241022
N-benzyl-5-[butyl(methyl)amino]pyridine-3-carboxamide
CID 109231681
5-[butyl(methyl)amino]-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide
CID 109240384
5-[butyl(methyl)amino]-N-cyclopropylpyridine-3-carboxamide
CID 109223633
5-[benzyl(ethyl)amino]-N-phenylpyridine-3-carboxamide
CID 109234844
N-[4-(dimethylamino)phenyl]-5-(dipropylamino)pyridine-3-carboxamide
CID 109241081
5-[benzyl(methyl)amino]-N-(4-ethoxyphenyl)pyridine-3-carboxamide
CID 109233234
5-[butyl(methyl)amino]-N-[4-chloro-2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 109240451
5-[butyl(methyl)amino]-N,N-diethylpyridine-3-carboxamide
CID 109238765
5-[benzyl(methyl)amino]-N-(3,5-dimethylphenyl)pyridine-3-carboxamide
CID 109233203

Frequently Asked Questions

What is the IUPAC name of 5-[butyl(methyl)amino]-N-phenylpyridine-3-carboxamide?
The IUPAC name of 5-[butyl(methyl)amino]-N-phenylpyridine-3-carboxamide (CID 109240365) is 5-[butyl(methyl)amino]-N-phenylpyridine-3-carboxamide.
What is the SMILES notation for 5-[butyl(methyl)amino]-N-phenylpyridine-3-carboxamide?
The canonical SMILES for 5-[butyl(methyl)amino]-N-phenylpyridine-3-carboxamide is CCCCN(C)c1cncc(C(=O)Nc2ccccc2)c1.
What is the InChIKey of 5-[butyl(methyl)amino]-N-phenylpyridine-3-carboxamide?
The InChIKey is UXQPPXGTSOPHQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-3-4-10-20(2)16-11-14(12-18-13-16)17(21)19-15-8-6-5-7-9-15/h5-9,11-13H,3-4,10H2,1-2H3,(H,19,21).
What are the key properties of 5-[butyl(methyl)amino]-N-phenylpyridine-3-carboxamide?
5-[butyl(methyl)amino]-N-phenylpyridine-3-carboxamide has a molecular weight of 283.38 g/mol, XLogP of 3.57, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[butyl(methyl)amino]-N-phenylpyridine-3-carboxamide is sourced from PubChem (CID 109240365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).