1-cyclopropyl-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine

C11H13F3N2 — CID 105157141

IUPAC1-cyclopropyl-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine
SMILESCNC(c1ccc(C(F)(F)F)cn1)C1CC1
InChIInChI=1S/C11H13F3N2/c1-15-10(7-2-3-7)9-5-4-8(6-16-9)11(12,13)14/h4-7,10,15H,2-3H2,1H3
InChIKeyMTSYBFPDTLVLGN-UHFFFAOYSA-N
MW230.23 g/mol
LogP2.77
Rot. Bonds3

About 1-cyclopropyl-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine

1-cyclopropyl-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine (PubChem CID 105157141) has the molecular formula C11H13F3N2 and a molecular weight of 230.23 g/mol. Its IUPAC name is 1-cyclopropyl-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine
PubChem CID105157141
Molecular FormulaC11H13F3N2
Molecular Weight230.23 g/mol
Exact Mass230.10
IUPAC Name1-cyclopropyl-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine
SMILESCNC(c1ccc(C(F)(F)F)cn1)C1CC1
InChIInChI=1S/C11H13F3N2/c1-15-10(7-2-3-7)9-5-4-8(6-16-9)11(12,13)14/h4-7,10,15H,2-3H2,1H3
InChIKeyMTSYBFPDTLVLGN-UHFFFAOYSA-N
XLogP2.77
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.23
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine?
The IUPAC name of 1-cyclopropyl-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine (CID 105157141) is 1-cyclopropyl-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine.
What is the SMILES notation for 1-cyclopropyl-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine?
The canonical SMILES for 1-cyclopropyl-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine is CNC(c1ccc(C(F)(F)F)cn1)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine?
The InChIKey is MTSYBFPDTLVLGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F3N2/c1-15-10(7-2-3-7)9-5-4-8(6-16-9)11(12,13)14/h4-7,10,15H,2-3H2,1H3.
What are the key properties of 1-cyclopropyl-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine?
1-cyclopropyl-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine has a molecular weight of 230.23 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-methyl-1-[5-(trifluoromethyl)-2-pyridinyl]methanamine is sourced from PubChem (CID 105157141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).