N-(azetidin-3-yl)-N-methyl-3-(trifluoromethyl)pyridin-2-amine

C10H12F3N3 — CID 66181620

IUPACN-(azetidin-3-yl)-N-methyl-3-(trifluoromethyl)pyridin-2-amine
SMILESCN(c1ncccc1C(F)(F)F)C1CNC1
InChIInChI=1S/C10H12F3N3/c1-16(7-5-14-6-7)9-8(10(11,12)13)3-2-4-15-9/h2-4,7,14H,5-6H2,1H3
InChIKeyCYODBOBXDSNZPC-UHFFFAOYSA-N
MW231.22 g/mol
LogP1.51
Rot. Bonds2

About N-(azetidin-3-yl)-N-methyl-3-(trifluoromethyl)pyridin-2-amine

N-(azetidin-3-yl)-N-methyl-3-(trifluoromethyl)pyridin-2-amine (PubChem CID 66181620) has the molecular formula C10H12F3N3 and a molecular weight of 231.22 g/mol. Its IUPAC name is N-(azetidin-3-yl)-N-methyl-3-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-(azetidin-3-yl)-N-methyl-3-(trifluoromethyl)pyridin-2-amine
PubChem CID66181620
Molecular FormulaC10H12F3N3
Molecular Weight231.22 g/mol
Exact Mass231.10
IUPAC NameN-(azetidin-3-yl)-N-methyl-3-(trifluoromethyl)pyridin-2-amine
SMILESCN(c1ncccc1C(F)(F)F)C1CNC1
InChIInChI=1S/C10H12F3N3/c1-16(7-5-14-6-7)9-8(10(11,12)13)3-2-4-15-9/h2-4,7,14H,5-6H2,1H3
InChIKeyCYODBOBXDSNZPC-UHFFFAOYSA-N
XLogP1.51
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.22
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-N-methyl-3-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-(azetidin-3-yl)-N-methyl-3-(trifluoromethyl)pyridin-2-amine (CID 66181620) is N-(azetidin-3-yl)-N-methyl-3-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-(azetidin-3-yl)-N-methyl-3-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-(azetidin-3-yl)-N-methyl-3-(trifluoromethyl)pyridin-2-amine is CN(c1ncccc1C(F)(F)F)C1CNC1.
What is the InChIKey of N-(azetidin-3-yl)-N-methyl-3-(trifluoromethyl)pyridin-2-amine?
The InChIKey is CYODBOBXDSNZPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3N3/c1-16(7-5-14-6-7)9-8(10(11,12)13)3-2-4-15-9/h2-4,7,14H,5-6H2,1H3.
What are the key properties of N-(azetidin-3-yl)-N-methyl-3-(trifluoromethyl)pyridin-2-amine?
N-(azetidin-3-yl)-N-methyl-3-(trifluoromethyl)pyridin-2-amine has a molecular weight of 231.22 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-N-methyl-3-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 66181620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).