N-ethyl-6,6,6-trifluoro-1-(1-methoxycyclobutyl)hexan-2-amine

C13H24F3NO — CID 103559715

IUPACN-ethyl-6,6,6-trifluoro-1-(1-methoxycyclobutyl)hexan-2-amine
SMILESCCNC(CCCC(F)(F)F)CC1(OC)CCC1
InChIInChI=1S/C13H24F3NO/c1-3-17-11(6-4-9-13(14,15)16)10-12(18-2)7-5-8-12/h11,17H,3-10H2,1-2H3
InChIKeyXURDEMUKKXJSGF-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.66
Rot. Bonds8

About N-ethyl-6,6,6-trifluoro-1-(1-methoxycyclobutyl)hexan-2-amine

N-ethyl-6,6,6-trifluoro-1-(1-methoxycyclobutyl)hexan-2-amine (PubChem CID 103559715) has the molecular formula C13H24F3NO and a molecular weight of 267.33 g/mol. Its IUPAC name is N-ethyl-6,6,6-trifluoro-1-(1-methoxycyclobutyl)hexan-2-amine.

Molecular Properties

Compound NameN-ethyl-6,6,6-trifluoro-1-(1-methoxycyclobutyl)hexan-2-amine
PubChem CID103559715
Molecular FormulaC13H24F3NO
Molecular Weight267.33 g/mol
Exact Mass267.18
IUPAC NameN-ethyl-6,6,6-trifluoro-1-(1-methoxycyclobutyl)hexan-2-amine
SMILESCCNC(CCCC(F)(F)F)CC1(OC)CCC1
InChIInChI=1S/C13H24F3NO/c1-3-17-11(6-4-9-13(14,15)16)10-12(18-2)7-5-8-12/h11,17H,3-10H2,1-2H3
InChIKeyXURDEMUKKXJSGF-UHFFFAOYSA-N
XLogP3.66
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethyl-6,6,6-trifluoro-1-(1-methoxycyclobutyl)hexan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(3-methylnonan-3-yloxy)-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 129276996
2-ethyl-2-methyl-N-(3,3,3-trifluoropropyl)oxan-4-amine
CID 64102494
2-ethyl-2-methyl-N-(2,2,2-trifluoroethyl)oxan-4-amine
CID 64106293
3-ethoxy-N-(2,2,2-trifluoroethyl)spiro[3.4]octan-1-amine
CID 64863452
3-ethoxy-N-(3,3,3-trifluoropropyl)spiro[3.4]octan-1-amine
CID 64863866
3-ethoxy-N-(3,3,3-trifluoropropyl)spiro[3.5]nonan-1-amine
CID 65169610
3-ethoxy-N-(2,2,2-trifluoroethyl)spiro[3.5]nonan-1-amine
CID 65170650
N-propyl-3-(1,1,1-trifluoropropan-2-yloxy)spiro[3.5]nonan-1-amine
CID 66350084
N-propyl-3-(1,1,1-trifluoropropan-2-yloxy)spiro[3.4]octan-1-amine
CID 66350529
N-ethyl-3-(1,1,1-trifluoropropan-2-yloxy)spiro[3.4]octan-1-amine
CID 66350530
N-ethyl-3-(1,1,1-trifluoropropan-2-yloxy)spiro[3.5]nonan-1-amine
CID 66350745
N-methyl-3-(1,1,1-trifluoropropan-2-yloxy)spiro[3.5]nonan-1-amine
CID 66350971

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6,6,6-trifluoro-1-(1-methoxycyclobutyl)hexan-2-amine?
The IUPAC name of N-ethyl-6,6,6-trifluoro-1-(1-methoxycyclobutyl)hexan-2-amine (CID 103559715) is N-ethyl-6,6,6-trifluoro-1-(1-methoxycyclobutyl)hexan-2-amine.
What is the SMILES notation for N-ethyl-6,6,6-trifluoro-1-(1-methoxycyclobutyl)hexan-2-amine?
The canonical SMILES for N-ethyl-6,6,6-trifluoro-1-(1-methoxycyclobutyl)hexan-2-amine is CCNC(CCCC(F)(F)F)CC1(OC)CCC1.
What is the InChIKey of N-ethyl-6,6,6-trifluoro-1-(1-methoxycyclobutyl)hexan-2-amine?
The InChIKey is XURDEMUKKXJSGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24F3NO/c1-3-17-11(6-4-9-13(14,15)16)10-12(18-2)7-5-8-12/h11,17H,3-10H2,1-2H3.
What are the key properties of N-ethyl-6,6,6-trifluoro-1-(1-methoxycyclobutyl)hexan-2-amine?
N-ethyl-6,6,6-trifluoro-1-(1-methoxycyclobutyl)hexan-2-amine has a molecular weight of 267.33 g/mol, XLogP of 3.66, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6,6,6-trifluoro-1-(1-methoxycyclobutyl)hexan-2-amine is sourced from PubChem (CID 103559715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).