6-cyclopropyl-4-(trifluoromethyl)-1H-pyridin-2-one

C9H8F3NO — CID 106516161

IUPAC6-cyclopropyl-4-(trifluoromethyl)-1H-pyridin-2-one
SMILESC1CC1C2=CC(=CC(=O)N2)C(F)(F)F
InChIInChI=1S/C9H8F3NO/c10-9(11,12)6-3-7(5-1-2-5)13-8(14)4-6/h3-5H,1-2H2,(H,13,14)
InChIKeyXNXKKIVUGZRJAK-UHFFFAOYSA-N
MW203.16 g/mol
LogP1.20
Rot. Bonds1

About 6-cyclopropyl-4-(trifluoromethyl)-1H-pyridin-2-one

6-cyclopropyl-4-(trifluoromethyl)-1H-pyridin-2-one (PubChem CID 106516161) has the molecular formula C9H8F3NO and a molecular weight of 203.16 g/mol. Its IUPAC name is 6-cyclopropyl-4-(trifluoromethyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name6-cyclopropyl-4-(trifluoromethyl)-1H-pyridin-2-one
PubChem CID106516161
Molecular FormulaC9H8F3NO
Molecular Weight203.16 g/mol
Exact Mass203.06
IUPAC Name6-cyclopropyl-4-(trifluoromethyl)-1H-pyridin-2-one
SMILESC1CC1C2=CC(=CC(=O)N2)C(F)(F)F
InChIInChI=1S/C9H8F3NO/c10-9(11,12)6-3-7(5-1-2-5)13-8(14)4-6/h3-5H,1-2H2,(H,13,14)
InChIKeyXNXKKIVUGZRJAK-UHFFFAOYSA-N
XLogP1.20
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity336

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.16
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-Cyclopropyl-2-oxo-4-(trifluoromethyl)-1,2-dihydro-3-pyridinecarbonitrile
CID 4302841
4-methyl-6-(1,1,2,2,2-pentafluoroethyl)-1H-pyridin-2-one
CID 10105131
3,6-dimethyl-4-(trifluoromethyl)-1H-pyridin-2-one
CID 15210459
6-(2,2,2-Trifluoroethyl)-4-(trifluoromethyl)-1,5-dihydropyrrolo[2,3-g]quinolin-2-one
CID 22218162
6-propan-2-yl-5-(trifluoromethyl)-1H-pyridin-2-one
CID 59665145
6-amino-4-(trifluoromethyl)-7,8-dihydro-1H-quinolin-2-one
CID 70023407
3-Ethyl-6-(trifluoromethyl)pyridin-2-ol
CID 89003285
4-fluoro-6-propan-2-yl-1H-pyridin-2-one
CID 89973677
6-propan-2-yl-4-(trifluoromethyl)-1H-pyridin-2-one
CID 106517869
4-(1,1-difluoropropyl)-6-methyl-1H-pyridin-2-one
CID 121440112
3-(difluoromethyl)-5,6-diethyl-1H-pyridin-2-one
CID 123654562
N-[6-methyl-3-(trifluoromethyl)cyclohexa-1,3-dien-1-yl]acetamide
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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-4-(trifluoromethyl)-1H-pyridin-2-one?
The IUPAC name of 6-cyclopropyl-4-(trifluoromethyl)-1H-pyridin-2-one (CID 106516161) is 6-cyclopropyl-4-(trifluoromethyl)-1H-pyridin-2-one.
What is the SMILES notation for 6-cyclopropyl-4-(trifluoromethyl)-1H-pyridin-2-one?
The canonical SMILES for 6-cyclopropyl-4-(trifluoromethyl)-1H-pyridin-2-one is C1CC1C2=CC(=CC(=O)N2)C(F)(F)F.
What is the InChIKey of 6-cyclopropyl-4-(trifluoromethyl)-1H-pyridin-2-one?
The InChIKey is XNXKKIVUGZRJAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F3NO/c10-9(11,12)6-3-7(5-1-2-5)13-8(14)4-6/h3-5H,1-2H2,(H,13,14).
What are the key properties of 6-cyclopropyl-4-(trifluoromethyl)-1H-pyridin-2-one?
6-cyclopropyl-4-(trifluoromethyl)-1H-pyridin-2-one has a molecular weight of 203.16 g/mol, XLogP of 1.20, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-4-(trifluoromethyl)-1H-pyridin-2-one is sourced from PubChem (CID 106516161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).