1-cyclohexyl-N-ethyl-5,5,5-trifluoro-1-methoxypentan-2-amine

C14H26F3NO — CID 116771700

IUPAC1-cyclohexyl-N-ethyl-5,5,5-trifluoro-1-methoxypentan-2-amine
SMILESCCNC(CCC(F)(F)F)C(OC)C1CCCCC1
InChIInChI=1S/C14H26F3NO/c1-3-18-12(9-10-14(15,16)17)13(19-2)11-7-5-4-6-8-11/h11-13,18H,3-10H2,1-2H3
InChIKeyYOSQYHNPYXOIQP-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.90
Rot. Bonds7

About 1-cyclohexyl-N-ethyl-5,5,5-trifluoro-1-methoxypentan-2-amine

1-cyclohexyl-N-ethyl-5,5,5-trifluoro-1-methoxypentan-2-amine (PubChem CID 116771700) has the molecular formula C14H26F3NO and a molecular weight of 281.36 g/mol. Its IUPAC name is 1-cyclohexyl-N-ethyl-5,5,5-trifluoro-1-methoxypentan-2-amine.

Molecular Properties

Compound Name1-cyclohexyl-N-ethyl-5,5,5-trifluoro-1-methoxypentan-2-amine
PubChem CID116771700
Molecular FormulaC14H26F3NO
Molecular Weight281.36 g/mol
Exact Mass281.20
IUPAC Name1-cyclohexyl-N-ethyl-5,5,5-trifluoro-1-methoxypentan-2-amine
SMILESCCNC(CCC(F)(F)F)C(OC)C1CCCCC1
InChIInChI=1S/C14H26F3NO/c1-3-18-12(9-10-14(15,16)17)13(19-2)11-7-5-4-6-8-11/h11-13,18H,3-10H2,1-2H3
InChIKeyYOSQYHNPYXOIQP-UHFFFAOYSA-N
XLogP3.90
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclohexyl-1-ethoxy-N-ethyl-5,5,5-trifluoropentan-2-amine
CID 116772369
1-cyclohexyl-N-ethyl-1-methoxyhept-6-yn-2-amine
CID 116771722
1-cyclopentyl-N-ethyl-4,4,4-trifluorobutan-1-amine
CID 64565156
1,2-dicyclohexyl-N-ethyl-2-methoxyethanamine
CID 116771642
1-cyclohexyl-N-ethyl-1-methoxy-3-methylbutan-2-amine
CID 116771723
1-cyclohexyl-N-ethyl-1-methoxy-4-(2-methylpyrazol-3-yl)butan-2-amine
CID 103012610
1-cyclohexyl-N-ethyl-1-methoxy-3-methylhexan-2-amine
CID 114013848
1-cyclohexyl-1-methoxy-6-methyl-N-propylheptan-2-amine
CID 116771907
1-cyclopropyl-N-ethyl-1-methoxyhept-6-yn-2-amine
CID 116722520
1-cyclohexyl-1-methoxy-N-propylhept-5-yn-2-amine
CID 116771813
3-(5-bromothiophen-2-yl)-1-cyclohexyl-N-ethyl-1-methoxypropan-2-amine
CID 116771653
1-cyclohexyl-1-methoxy-4-methyl-N-propylheptan-2-amine
CID 116771857

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-ethyl-5,5,5-trifluoro-1-methoxypentan-2-amine?
The IUPAC name of 1-cyclohexyl-N-ethyl-5,5,5-trifluoro-1-methoxypentan-2-amine (CID 116771700) is 1-cyclohexyl-N-ethyl-5,5,5-trifluoro-1-methoxypentan-2-amine.
What is the SMILES notation for 1-cyclohexyl-N-ethyl-5,5,5-trifluoro-1-methoxypentan-2-amine?
The canonical SMILES for 1-cyclohexyl-N-ethyl-5,5,5-trifluoro-1-methoxypentan-2-amine is CCNC(CCC(F)(F)F)C(OC)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-ethyl-5,5,5-trifluoro-1-methoxypentan-2-amine?
The InChIKey is YOSQYHNPYXOIQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26F3NO/c1-3-18-12(9-10-14(15,16)17)13(19-2)11-7-5-4-6-8-11/h11-13,18H,3-10H2,1-2H3.
What are the key properties of 1-cyclohexyl-N-ethyl-5,5,5-trifluoro-1-methoxypentan-2-amine?
1-cyclohexyl-N-ethyl-5,5,5-trifluoro-1-methoxypentan-2-amine has a molecular weight of 281.36 g/mol, XLogP of 3.90, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-ethyl-5,5,5-trifluoro-1-methoxypentan-2-amine is sourced from PubChem (CID 116771700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).