1-cyclopentyl-4,4,4-trifluoro-N-methylbutan-2-amine

C10H18F3N — CID 62603326

IUPAC1-cyclopentyl-4,4,4-trifluoro-N-methylbutan-2-amine
SMILESCNC(CC1CCCC1)CC(F)(F)F
InChIInChI=1S/C10H18F3N/c1-14-9(7-10(11,12)13)6-8-4-2-3-5-8/h8-9,14H,2-7H2,1H3
InChIKeyIPYXSZSVSIVOAJ-UHFFFAOYSA-N
MW209.25 g/mol
LogP3.11
Rot. Bonds4

About 1-cyclopentyl-4,4,4-trifluoro-N-methylbutan-2-amine

1-cyclopentyl-4,4,4-trifluoro-N-methylbutan-2-amine (PubChem CID 62603326) has the molecular formula C10H18F3N and a molecular weight of 209.25 g/mol. Its IUPAC name is 1-cyclopentyl-4,4,4-trifluoro-N-methylbutan-2-amine.

Molecular Properties

Compound Name1-cyclopentyl-4,4,4-trifluoro-N-methylbutan-2-amine
PubChem CID62603326
Molecular FormulaC10H18F3N
Molecular Weight209.25 g/mol
Exact Mass209.14
IUPAC Name1-cyclopentyl-4,4,4-trifluoro-N-methylbutan-2-amine
SMILESCNC(CC1CCCC1)CC(F)(F)F
InChIInChI=1S/C10H18F3N/c1-14-9(7-10(11,12)13)6-8-4-2-3-5-8/h8-9,14H,2-7H2,1H3
InChIKeyIPYXSZSVSIVOAJ-UHFFFAOYSA-N
XLogP3.11
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclopentyl-4,4,4-trifluoro-N-propylbutan-2-amine
CID 62604821
(1-cyclopropyl-4,4,4-trifluorobutan-2-yl)hydrazine
CID 105205837
(2R)-3-cyclohexyl-1-N,1-N,2-N-trimethylpropane-1,2-diamine
CID 58597797
1-cyclohexyl-N-methylbutan-2-amine
CID 62601734
1-cyclopentyl-N-methyl-3-(thian-4-yl)propan-2-amine
CID 105138955
1-cycloheptyl-N,6,6-trimethylheptan-2-amine
CID 114211051
(1-cyclononyl-4,4,4-trifluorobutan-2-yl)-methylxenon
CID 163910604
1-cycloheptyl-N-methylhexan-2-amine
CID 115832695
1-cyclobutyl-N,5,5-trimethylhexan-2-amine
CID 103168554
1-cyclohexyl-N-methylheptan-2-amine
CID 115836969
2-cyclopentyl-N-methyl-1-[2-(trifluoromethyl)cyclohexyl]ethanamine
CID 105139095
N,4,4-trimethyl-1-(oxan-4-yl)pentan-2-amine
CID 63891515

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-4,4,4-trifluoro-N-methylbutan-2-amine?
The IUPAC name of 1-cyclopentyl-4,4,4-trifluoro-N-methylbutan-2-amine (CID 62603326) is 1-cyclopentyl-4,4,4-trifluoro-N-methylbutan-2-amine.
What is the SMILES notation for 1-cyclopentyl-4,4,4-trifluoro-N-methylbutan-2-amine?
The canonical SMILES for 1-cyclopentyl-4,4,4-trifluoro-N-methylbutan-2-amine is CNC(CC1CCCC1)CC(F)(F)F.
What is the InChIKey of 1-cyclopentyl-4,4,4-trifluoro-N-methylbutan-2-amine?
The InChIKey is IPYXSZSVSIVOAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3N/c1-14-9(7-10(11,12)13)6-8-4-2-3-5-8/h8-9,14H,2-7H2,1H3.
What are the key properties of 1-cyclopentyl-4,4,4-trifluoro-N-methylbutan-2-amine?
1-cyclopentyl-4,4,4-trifluoro-N-methylbutan-2-amine has a molecular weight of 209.25 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-4,4,4-trifluoro-N-methylbutan-2-amine is sourced from PubChem (CID 62603326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).