2-(dimethylamino)-N-methyl-6-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide

C16H16F3N3O — CID 126474962

IUPAC2-(dimethylamino)-N-methyl-6-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide
SMILESCNC(=O)c1ccc(-c2cccc(C(F)(F)F)c2)nc1N(C)C
InChIInChI=1S/C16H16F3N3O/c1-20-15(23)12-7-8-13(21-14(12)22(2)3)10-5-4-6-11(9-10)16(17,18)19/h4-9H,1-3H3,(H,20,23)
InChIKeyNCDZEJIQGJDERD-UHFFFAOYSA-N
MW323.32 g/mol
LogP3.19
Rot. Bonds3

About 2-(dimethylamino)-N-methyl-6-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide

2-(dimethylamino)-N-methyl-6-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide (PubChem CID 126474962) has the molecular formula C16H16F3N3O and a molecular weight of 323.32 g/mol. Its IUPAC name is 2-(dimethylamino)-N-methyl-6-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-methyl-6-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide
PubChem CID126474962
Molecular FormulaC16H16F3N3O
Molecular Weight323.32 g/mol
Exact Mass323.12
IUPAC Name2-(dimethylamino)-N-methyl-6-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide
SMILESCNC(=O)c1ccc(-c2cccc(C(F)(F)F)c2)nc1N(C)C
InChIInChI=1S/C16H16F3N3O/c1-20-15(23)12-7-8-13(21-14(12)22(2)3)10-5-4-6-11(9-10)16(17,18)19/h4-9H,1-3H3,(H,20,23)
InChIKeyNCDZEJIQGJDERD-UHFFFAOYSA-N
XLogP3.19
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.32
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-methyl-6-[3-(trifluoromethyl)phenyl]pyridine-3-carboxylate
CID 69039624
2-(dimethylamino)-6-(1H-indol-5-yl)-N-methylpyridine-3-carboxamide
CID 126473475
N-methyl-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide
CID 6471602
N,N-dimethyl-3-[3-(trifluoromethyl)phenyl]benzamide
CID 166329824
3-fluoro-6-[3-(trifluoromethyl)phenyl]pyridine-2-carbaldehyde
CID 88932507
6-[3-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine
CID 67173582
methyl 5-amino-2-[3-(trifluoromethyl)phenyl]pyridine-4-carboxylate
CID 134635397
2-[3,6-bis[3-(trifluoromethyl)phenyl]-2-pyridinyl]acetic acid
CID 134623875
2-methyl-2-[6-[6-[3-(trifluoromethyl)phenyl]-2-pyridinyl]-2-pyridinyl]propanoic acid
CID 58004358
2-N-methyl-4-(trifluoromethyl)benzene-1,2-dicarboxamide
CID 70098702
3-(dimethylamino)-1-[3-[3-(trifluoromethyl)phenyl]-1,2-oxazol-5-yl]prop-2-en-1-one
CID 2745740
N,2-dimethyl-3-[[3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]methylamino]benzamide
CID 87029316

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-methyl-6-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide?
The IUPAC name of 2-(dimethylamino)-N-methyl-6-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide (CID 126474962) is 2-(dimethylamino)-N-methyl-6-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-(dimethylamino)-N-methyl-6-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide?
The canonical SMILES for 2-(dimethylamino)-N-methyl-6-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide is CNC(=O)c1ccc(-c2cccc(C(F)(F)F)c2)nc1N(C)C.
What is the InChIKey of 2-(dimethylamino)-N-methyl-6-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide?
The InChIKey is NCDZEJIQGJDERD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F3N3O/c1-20-15(23)12-7-8-13(21-14(12)22(2)3)10-5-4-6-11(9-10)16(17,18)19/h4-9H,1-3H3,(H,20,23).
What are the key properties of 2-(dimethylamino)-N-methyl-6-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide?
2-(dimethylamino)-N-methyl-6-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide has a molecular weight of 323.32 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-methyl-6-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 126474962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).