6-[2-(trifluoromethyl)cyclopropyl]pyridine-2-carboxamide

C10H9F3N2O — CID 171477770

IUPAC6-[2-(trifluoromethyl)cyclopropyl]pyridine-2-carboxamide
SMILESNC(=O)c1cccc(C2CC2C(F)(F)F)n1
InChIInChI=1S/C10H9F3N2O/c11-10(12,13)6-4-5(6)7-2-1-3-8(15-7)9(14)16/h1-3,5-6H,4H2,(H2,14,16)
InChIKeyBIHGHDGLYYLECE-UHFFFAOYSA-N
MW230.19 g/mol
LogP1.85
Rot. Bonds2

About 6-[2-(trifluoromethyl)cyclopropyl]pyridine-2-carboxamide

6-[2-(trifluoromethyl)cyclopropyl]pyridine-2-carboxamide (PubChem CID 171477770) has the molecular formula C10H9F3N2O and a molecular weight of 230.19 g/mol. Its IUPAC name is 6-[2-(trifluoromethyl)cyclopropyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-[2-(trifluoromethyl)cyclopropyl]pyridine-2-carboxamide
PubChem CID171477770
Molecular FormulaC10H9F3N2O
Molecular Weight230.19 g/mol
Exact Mass230.07
IUPAC Name6-[2-(trifluoromethyl)cyclopropyl]pyridine-2-carboxamide
SMILESNC(=O)c1cccc(C2CC2C(F)(F)F)n1
InChIInChI=1S/C10H9F3N2O/c11-10(12,13)6-4-5(6)7-2-1-3-8(15-7)9(14)16/h1-3,5-6H,4H2,(H2,14,16)
InChIKeyBIHGHDGLYYLECE-UHFFFAOYSA-N
XLogP1.85
TPSA55.98 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 ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(trifluoromethyl)cyclopropyl]pyridine-2-carboxamide?
The IUPAC name of 6-[2-(trifluoromethyl)cyclopropyl]pyridine-2-carboxamide (CID 171477770) is 6-[2-(trifluoromethyl)cyclopropyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-[2-(trifluoromethyl)cyclopropyl]pyridine-2-carboxamide?
The canonical SMILES for 6-[2-(trifluoromethyl)cyclopropyl]pyridine-2-carboxamide is NC(=O)c1cccc(C2CC2C(F)(F)F)n1.
What is the InChIKey of 6-[2-(trifluoromethyl)cyclopropyl]pyridine-2-carboxamide?
The InChIKey is BIHGHDGLYYLECE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N2O/c11-10(12,13)6-4-5(6)7-2-1-3-8(15-7)9(14)16/h1-3,5-6H,4H2,(H2,14,16).
What are the key properties of 6-[2-(trifluoromethyl)cyclopropyl]pyridine-2-carboxamide?
6-[2-(trifluoromethyl)cyclopropyl]pyridine-2-carboxamide has a molecular weight of 230.19 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(trifluoromethyl)cyclopropyl]pyridine-2-carboxamide is sourced from PubChem (CID 171477770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).