2-methyl-N-pyrrolidin-3-yl-6-(trifluoromethyl)pyridin-3-amine

C11H14F3N3 — CID 175911772

IUPAC2-methyl-N-pyrrolidin-3-yl-6-(trifluoromethyl)pyridin-3-amine
SMILESCc1nc(C(F)(F)F)ccc1NC1CCNC1
InChIInChI=1S/C11H14F3N3/c1-7-9(17-8-4-5-15-6-8)2-3-10(16-7)11(12,13)14/h2-3,8,15,17H,4-6H2,1H3
InChIKeyVVUIZEAPEKEATG-UHFFFAOYSA-N
MW245.25 g/mol
LogP2.18
Rot. Bonds2

About 2-methyl-N-pyrrolidin-3-yl-6-(trifluoromethyl)pyridin-3-amine

2-methyl-N-pyrrolidin-3-yl-6-(trifluoromethyl)pyridin-3-amine (PubChem CID 175911772) has the molecular formula C11H14F3N3 and a molecular weight of 245.25 g/mol. Its IUPAC name is 2-methyl-N-pyrrolidin-3-yl-6-(trifluoromethyl)pyridin-3-amine.

Molecular Properties

Compound Name2-methyl-N-pyrrolidin-3-yl-6-(trifluoromethyl)pyridin-3-amine
PubChem CID175911772
Molecular FormulaC11H14F3N3
Molecular Weight245.25 g/mol
Exact Mass245.11
IUPAC Name2-methyl-N-pyrrolidin-3-yl-6-(trifluoromethyl)pyridin-3-amine
SMILESCc1nc(C(F)(F)F)ccc1NC1CCNC1
InChIInChI=1S/C11H14F3N3/c1-7-9(17-8-4-5-15-6-8)2-3-10(16-7)11(12,13)14/h2-3,8,15,17H,4-6H2,1H3
InChIKeyVVUIZEAPEKEATG-UHFFFAOYSA-N
XLogP2.18
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.25
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-pyrrolidin-3-yl-6-(trifluoromethyl)pyridin-3-amine?
The IUPAC name of 2-methyl-N-pyrrolidin-3-yl-6-(trifluoromethyl)pyridin-3-amine (CID 175911772) is 2-methyl-N-pyrrolidin-3-yl-6-(trifluoromethyl)pyridin-3-amine.
What is the SMILES notation for 2-methyl-N-pyrrolidin-3-yl-6-(trifluoromethyl)pyridin-3-amine?
The canonical SMILES for 2-methyl-N-pyrrolidin-3-yl-6-(trifluoromethyl)pyridin-3-amine is Cc1nc(C(F)(F)F)ccc1NC1CCNC1.
What is the InChIKey of 2-methyl-N-pyrrolidin-3-yl-6-(trifluoromethyl)pyridin-3-amine?
The InChIKey is VVUIZEAPEKEATG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F3N3/c1-7-9(17-8-4-5-15-6-8)2-3-10(16-7)11(12,13)14/h2-3,8,15,17H,4-6H2,1H3.
What are the key properties of 2-methyl-N-pyrrolidin-3-yl-6-(trifluoromethyl)pyridin-3-amine?
2-methyl-N-pyrrolidin-3-yl-6-(trifluoromethyl)pyridin-3-amine has a molecular weight of 245.25 g/mol, XLogP of 2.18, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-pyrrolidin-3-yl-6-(trifluoromethyl)pyridin-3-amine is sourced from PubChem (CID 175911772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).