N-methyl-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-2-amine

C11H14F3N3 — CID 102717162

IUPACN-methyl-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-2-amine
SMILESCNc1cc(C(F)(F)F)cc(N2CCCC2)n1
InChIInChI=1S/C11H14F3N3/c1-15-9-6-8(11(12,13)14)7-10(16-9)17-4-2-3-5-17/h6-7H,2-5H2,1H3,(H,15,16)
InChIKeyHSONRHWOGJGCCJ-UHFFFAOYSA-N
MW245.25 g/mol
LogP2.74
Rot. Bonds2

About N-methyl-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-2-amine

N-methyl-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102717162) has the molecular formula C11H14F3N3 and a molecular weight of 245.25 g/mol. Its IUPAC name is N-methyl-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102717162
Molecular FormulaC11H14F3N3
Molecular Weight245.25 g/mol
Exact Mass245.11
IUPAC NameN-methyl-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-2-amine
SMILESCNc1cc(C(F)(F)F)cc(N2CCCC2)n1
InChIInChI=1S/C11H14F3N3/c1-15-9-6-8(11(12,13)14)7-10(16-9)17-4-2-3-5-17/h6-7H,2-5H2,1H3,(H,15,16)
InChIKeyHSONRHWOGJGCCJ-UHFFFAOYSA-N
XLogP2.74
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.25
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of N-methyl-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-2-amine (CID 102717162) is N-methyl-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for N-methyl-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for N-methyl-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-2-amine is CNc1cc(C(F)(F)F)cc(N2CCCC2)n1.
What is the InChIKey of N-methyl-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is HSONRHWOGJGCCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F3N3/c1-15-9-6-8(11(12,13)14)7-10(16-9)17-4-2-3-5-17/h6-7H,2-5H2,1H3,(H,15,16).
What are the key properties of N-methyl-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-2-amine?
N-methyl-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 245.25 g/mol, XLogP of 2.74, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-pyrrolidin-1-yl-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102717162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).