6-ethyl-2-propan-2-yl-3-(trifluoromethyl)pyridine;propan-1-amine

C14H23F3N2 — CID 177368065

IUPAC6-ethyl-2-propan-2-yl-3-(trifluoromethyl)pyridine;propan-1-amine
SMILESCCCN.CCc1ccc(C(F)(F)F)c(C(C)C)n1
InChIInChI=1S/C11H14F3N.C3H9N/c1-4-8-5-6-9(11(12,13)14)10(15-8)7(2)3;1-2-3-4/h5-7H,4H2,1-3H3;2-4H2,1H3
InChIKeySRBILZOAAZEFTM-UHFFFAOYSA-N
MW276.35 g/mol
LogP4.14
Rot. Bonds3

About 6-ethyl-2-propan-2-yl-3-(trifluoromethyl)pyridine;propan-1-amine

6-ethyl-2-propan-2-yl-3-(trifluoromethyl)pyridine;propan-1-amine (PubChem CID 177368065) has the molecular formula C14H23F3N2 and a molecular weight of 276.35 g/mol. Its IUPAC name is 6-ethyl-2-propan-2-yl-3-(trifluoromethyl)pyridine;propan-1-amine.

Molecular Properties

Compound Name6-ethyl-2-propan-2-yl-3-(trifluoromethyl)pyridine;propan-1-amine
PubChem CID177368065
Molecular FormulaC14H23F3N2
Molecular Weight276.35 g/mol
Exact Mass276.18
IUPAC Name6-ethyl-2-propan-2-yl-3-(trifluoromethyl)pyridine;propan-1-amine
SMILESCCCN.CCc1ccc(C(F)(F)F)c(C(C)C)n1
InChIInChI=1S/C11H14F3N.C3H9N/c1-4-8-5-6-9(11(12,13)14)10(15-8)7(2)3;1-2-3-4/h5-7H,4H2,1-3H3;2-4H2,1H3
InChIKeySRBILZOAAZEFTM-UHFFFAOYSA-N
XLogP4.14
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.35
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclobutyl-N-[[6-propan-2-yl-5-(trifluoromethyl)-2-pyridinyl]methyl]methanamine
CID 177368110
6-(bromomethyl)-2-(difluoromethyl)-3-(trifluoromethyl)pyridine
CID 134668697
[2-propan-2-yl-6-(trifluoromethyl)-3-pyridinyl]methanamine
CID 119054456
2-propan-2-yl-3-(trifluoromethyl)pyridine
CID 59735101
2-methyl-6-propyl-3-(trifluoromethyl)pyridine
CID 145086517
2-ethyl-6-propan-2-yl-1,5-naphthyridine
CID 166147038
2,3-dimethyl-6-propan-2-yl-5-(trifluoromethyl)pyridine
CID 146614926
2-methyl-4-propan-2-yl-5-(trifluoromethyl)pyrimidine
CID 139481004
[6-methyl-3-(trifluoromethyl)-2-pyridinyl]methanamine
CID 105444009
4-ethyl-2-propan-2-yl-1-(trifluoromethyl)benzene
CID 137409492
2-ethyl-4-propan-2-yl-1-(trifluoromethyl)benzene
CID 156849362
ethane;2-ethyl-4-propan-2-yl-1-(trifluoromethyl)benzene
CID 177155724

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-propan-2-yl-3-(trifluoromethyl)pyridine;propan-1-amine?
The IUPAC name of 6-ethyl-2-propan-2-yl-3-(trifluoromethyl)pyridine;propan-1-amine (CID 177368065) is 6-ethyl-2-propan-2-yl-3-(trifluoromethyl)pyridine;propan-1-amine.
What is the SMILES notation for 6-ethyl-2-propan-2-yl-3-(trifluoromethyl)pyridine;propan-1-amine?
The canonical SMILES for 6-ethyl-2-propan-2-yl-3-(trifluoromethyl)pyridine;propan-1-amine is CCCN.CCc1ccc(C(F)(F)F)c(C(C)C)n1.
What is the InChIKey of 6-ethyl-2-propan-2-yl-3-(trifluoromethyl)pyridine;propan-1-amine?
The InChIKey is SRBILZOAAZEFTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F3N.C3H9N/c1-4-8-5-6-9(11(12,13)14)10(15-8)7(2)3;1-2-3-4/h5-7H,4H2,1-3H3;2-4H2,1H3.
What are the key properties of 6-ethyl-2-propan-2-yl-3-(trifluoromethyl)pyridine;propan-1-amine?
6-ethyl-2-propan-2-yl-3-(trifluoromethyl)pyridine;propan-1-amine has a molecular weight of 276.35 g/mol, XLogP of 4.14, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-propan-2-yl-3-(trifluoromethyl)pyridine;propan-1-amine is sourced from PubChem (CID 177368065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).