N,N-dipropyl-8-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-2-amine

C17H24F3N — CID 15908435

IUPACN,N-dipropyl-8-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCCCN(CCC)C1CCc2cccc(C(F)(F)F)c2C1
InChIInChI=1S/C17H24F3N/c1-3-10-21(11-4-2)14-9-8-13-6-5-7-16(15(13)12-14)17(18,19)20/h5-7,14H,3-4,8-12H2,1-2H3
InChIKeyIUULONJIFOKODN-UHFFFAOYSA-N
MW299.38 g/mol
LogP4.68
Rot. Bonds5

About N,N-dipropyl-8-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-2-amine

N,N-dipropyl-8-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-2-amine (PubChem CID 15908435) has the molecular formula C17H24F3N and a molecular weight of 299.38 g/mol. Its IUPAC name is N,N-dipropyl-8-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound NameN,N-dipropyl-8-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
PubChem CID15908435
Molecular FormulaC17H24F3N
Molecular Weight299.38 g/mol
Exact Mass299.19
IUPAC NameN,N-dipropyl-8-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCCCN(CCC)C1CCc2cccc(C(F)(F)F)c2C1
InChIInChI=1S/C17H24F3N/c1-3-10-21(11-4-2)14-9-8-13-6-5-7-16(15(13)12-14)17(18,19)20/h5-7,14H,3-4,8-12H2,1-2H3
InChIKeyIUULONJIFOKODN-UHFFFAOYSA-N
XLogP4.68
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.38
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-dipropyl-8-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-2-amine?
The IUPAC name of N,N-dipropyl-8-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-2-amine (CID 15908435) is N,N-dipropyl-8-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-2-amine.
What is the SMILES notation for N,N-dipropyl-8-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-2-amine?
The canonical SMILES for N,N-dipropyl-8-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-2-amine is CCCN(CCC)C1CCc2cccc(C(F)(F)F)c2C1.
What is the InChIKey of N,N-dipropyl-8-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-2-amine?
The InChIKey is IUULONJIFOKODN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24F3N/c1-3-10-21(11-4-2)14-9-8-13-6-5-7-16(15(13)12-14)17(18,19)20/h5-7,14H,3-4,8-12H2,1-2H3.
What are the key properties of N,N-dipropyl-8-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-2-amine?
N,N-dipropyl-8-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-2-amine has a molecular weight of 299.38 g/mol, XLogP of 4.68, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipropyl-8-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 15908435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).