N,2-dimethyl-N-propan-2-yl-6-(trifluoromethyl)pyridine-3-carboxamide

C12H15F3N2O — CID 69435136

IUPACN,2-dimethyl-N-propan-2-yl-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESCc1nc(C(F)(F)F)ccc1C(=O)N(C)C(C)C
InChIInChI=1S/C12H15F3N2O/c1-7(2)17(4)11(18)9-5-6-10(12(13,14)15)16-8(9)3/h5-7H,1-4H3
InChIKeyUTDYBEOMECVXNJ-UHFFFAOYSA-N
MW260.26 g/mol
LogP2.89
Rot. Bonds2

About N,2-dimethyl-N-propan-2-yl-6-(trifluoromethyl)pyridine-3-carboxamide

N,2-dimethyl-N-propan-2-yl-6-(trifluoromethyl)pyridine-3-carboxamide (PubChem CID 69435136) has the molecular formula C12H15F3N2O and a molecular weight of 260.26 g/mol. Its IUPAC name is N,2-dimethyl-N-propan-2-yl-6-(trifluoromethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN,2-dimethyl-N-propan-2-yl-6-(trifluoromethyl)pyridine-3-carboxamide
PubChem CID69435136
Molecular FormulaC12H15F3N2O
Molecular Weight260.26 g/mol
Exact Mass260.11
IUPAC NameN,2-dimethyl-N-propan-2-yl-6-(trifluoromethyl)pyridine-3-carboxamide
SMILESCc1nc(C(F)(F)F)ccc1C(=O)N(C)C(C)C
InChIInChI=1S/C12H15F3N2O/c1-7(2)17(4)11(18)9-5-6-10(12(13,14)15)16-8(9)3/h5-7H,1-4H3
InChIKeyUTDYBEOMECVXNJ-UHFFFAOYSA-N
XLogP2.89
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.26
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-aminopropan-2-yl)-N,2-dimethyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 119581336
N,2-dimethyl-N-[2-[methyl-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]ethyl]-6-(trifluoromethyl)pyridine-3-carboxamide
CID 112843308
1-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]ethanone
CID 2782900
3-methyl-1-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]butan-1-one
CID 167670286
1-[methyl-[2-methyl-6-(trifluoromethyl)pyridine-3-carbonyl]amino]cyclohexane-1-carboxylic acid
CID 120540042
N-(3-aminobutyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 119494830
N-[(2S)-1-amino-1-oxopropan-2-yl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 97311248
N-[(3-fluorophenyl)methyl]-N,2-dimethyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 78852267
2-[methyl(propan-2-yl)amino]-6-(trifluoromethyl)pyridine-3-carboxamide
CID 79869003
N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 31908536
N-[(2S)-1-aminopropan-2-yl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;hydrochloride
CID 120506183
N-(2-aminoethyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 119382029

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-propan-2-yl-6-(trifluoromethyl)pyridine-3-carboxamide?
The IUPAC name of N,2-dimethyl-N-propan-2-yl-6-(trifluoromethyl)pyridine-3-carboxamide (CID 69435136) is N,2-dimethyl-N-propan-2-yl-6-(trifluoromethyl)pyridine-3-carboxamide.
What is the SMILES notation for N,2-dimethyl-N-propan-2-yl-6-(trifluoromethyl)pyridine-3-carboxamide?
The canonical SMILES for N,2-dimethyl-N-propan-2-yl-6-(trifluoromethyl)pyridine-3-carboxamide is Cc1nc(C(F)(F)F)ccc1C(=O)N(C)C(C)C.
What is the InChIKey of N,2-dimethyl-N-propan-2-yl-6-(trifluoromethyl)pyridine-3-carboxamide?
The InChIKey is UTDYBEOMECVXNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F3N2O/c1-7(2)17(4)11(18)9-5-6-10(12(13,14)15)16-8(9)3/h5-7H,1-4H3.
What are the key properties of N,2-dimethyl-N-propan-2-yl-6-(trifluoromethyl)pyridine-3-carboxamide?
N,2-dimethyl-N-propan-2-yl-6-(trifluoromethyl)pyridine-3-carboxamide has a molecular weight of 260.26 g/mol, XLogP of 2.89, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-propan-2-yl-6-(trifluoromethyl)pyridine-3-carboxamide is sourced from PubChem (CID 69435136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).