N-[6-(trifluoromethyl)-3-pyridinyl]cyclopropanecarboxamide

C10H9F3N2O — CID 82707218

IUPACN-[6-(trifluoromethyl)-3-pyridinyl]cyclopropanecarboxamide
SMILESO=C(Nc1ccc(C(F)(F)F)nc1)C1CC1
InChIInChI=1S/C10H9F3N2O/c11-10(12,13)8-4-3-7(5-14-8)15-9(16)6-1-2-6/h3-6H,1-2H2,(H,15,16)
InChIKeyIIXBFGNFUXWCGC-UHFFFAOYSA-N
MW230.19 g/mol
LogP2.45
Rot. Bonds2

About N-[6-(trifluoromethyl)-3-pyridinyl]cyclopropanecarboxamide

N-[6-(trifluoromethyl)-3-pyridinyl]cyclopropanecarboxamide (PubChem CID 82707218) has the molecular formula C10H9F3N2O and a molecular weight of 230.19 g/mol. Its IUPAC name is N-[6-(trifluoromethyl)-3-pyridinyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[6-(trifluoromethyl)-3-pyridinyl]cyclopropanecarboxamide
PubChem CID82707218
Molecular FormulaC10H9F3N2O
Molecular Weight230.19 g/mol
Exact Mass230.07
IUPAC NameN-[6-(trifluoromethyl)-3-pyridinyl]cyclopropanecarboxamide
SMILESO=C(Nc1ccc(C(F)(F)F)nc1)C1CC1
InChIInChI=1S/C10H9F3N2O/c11-10(12,13)8-4-3-7(5-14-8)15-9(16)6-1-2-6/h3-6H,1-2H2,(H,15,16)
InChIKeyIIXBFGNFUXWCGC-UHFFFAOYSA-N
XLogP2.45
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.19
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[6-(trifluoromethyl)-3-pyridinyl]acetamide
CID 59578511
2-amino-N-[6-(trifluoromethyl)-3-pyridinyl]cycloheptane-1-carboxamide
CID 82795257
N-[6-(trifluoromethyl)-3-pyridinyl]pyrrolidine-1-carboxamide
CID 115778116
N-(6-bromo-3-pyridinyl)-4-(trifluoromethyl)cyclohexane-1-carboxamide
CID 106832051
N-[6-(trifluoromethyl)-3-pyridinyl]-1,3-thiazolidine-4-carboxamide
CID 82817480
trans-(1S,3S)-2,2-dimethyl-3-[[6-(trifluoromethyl)-3-pyridinyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 95389113
N-[6-(trifluoromethyl)-3-pyridinyl]morpholine-3-carboxamide
CID 82817726
2-bromo-2-methyl-N-[6-(trifluoromethyl)-3-pyridinyl]propanamide
CID 114329026
2-methyl-N-[6-(trifluoromethyl)-3-pyridinyl]propanamide
CID 82706557
N-(4-fluorophenyl)cyclopropanecarboxamide
CID 532027
4-(cyclopropanecarbonylamino)benzenesulfonyl chloride
CID 16774559
N-[4-fluoro-3-(trifluoromethyl)phenyl]cyclopropanecarboxamide
CID 47081962

Frequently Asked Questions

What is the IUPAC name of N-[6-(trifluoromethyl)-3-pyridinyl]cyclopropanecarboxamide?
The IUPAC name of N-[6-(trifluoromethyl)-3-pyridinyl]cyclopropanecarboxamide (CID 82707218) is N-[6-(trifluoromethyl)-3-pyridinyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[6-(trifluoromethyl)-3-pyridinyl]cyclopropanecarboxamide?
The canonical SMILES for N-[6-(trifluoromethyl)-3-pyridinyl]cyclopropanecarboxamide is O=C(Nc1ccc(C(F)(F)F)nc1)C1CC1.
What is the InChIKey of N-[6-(trifluoromethyl)-3-pyridinyl]cyclopropanecarboxamide?
The InChIKey is IIXBFGNFUXWCGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N2O/c11-10(12,13)8-4-3-7(5-14-8)15-9(16)6-1-2-6/h3-6H,1-2H2,(H,15,16).
What are the key properties of N-[6-(trifluoromethyl)-3-pyridinyl]cyclopropanecarboxamide?
N-[6-(trifluoromethyl)-3-pyridinyl]cyclopropanecarboxamide has a molecular weight of 230.19 g/mol, XLogP of 2.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(trifluoromethyl)-3-pyridinyl]cyclopropanecarboxamide is sourced from PubChem (CID 82707218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).