1-cyclopentyl-3-(2,2,2-trifluoroethoxy)propan-2-amine

C10H18F3NO — CID 103215066

IUPAC1-cyclopentyl-3-(2,2,2-trifluoroethoxy)propan-2-amine
SMILESNC(COCC(F)(F)F)CC1CCCC1
InChIInChI=1S/C10H18F3NO/c11-10(12,13)7-15-6-9(14)5-8-3-1-2-4-8/h8-9H,1-7,14H2
InChIKeyMAXHEIZUTBINPD-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.47
Rot. Bonds5

About 1-cyclopentyl-3-(2,2,2-trifluoroethoxy)propan-2-amine

1-cyclopentyl-3-(2,2,2-trifluoroethoxy)propan-2-amine (PubChem CID 103215066) has the molecular formula C10H18F3NO and a molecular weight of 225.25 g/mol. Its IUPAC name is 1-cyclopentyl-3-(2,2,2-trifluoroethoxy)propan-2-amine.

Molecular Properties

Compound Name1-cyclopentyl-3-(2,2,2-trifluoroethoxy)propan-2-amine
PubChem CID103215066
Molecular FormulaC10H18F3NO
Molecular Weight225.25 g/mol
Exact Mass225.13
IUPAC Name1-cyclopentyl-3-(2,2,2-trifluoroethoxy)propan-2-amine
SMILESNC(COCC(F)(F)F)CC1CCCC1
InChIInChI=1S/C10H18F3NO/c11-10(12,13)7-15-6-9(14)5-8-3-1-2-4-8/h8-9H,1-7,14H2
InChIKeyMAXHEIZUTBINPD-UHFFFAOYSA-N
XLogP2.47
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(2S)-2-amino-3-[(3R,4S)-3,4-difluorocyclopentyl]propyl] acetate
CID 68708920
1-Cyclohexyl-4-(2,2,2-trifluoroethoxy)butan-1-amine
CID 55095682
2-[2-(2,2,2-Trifluoroethoxy)ethyl]cyclohexan-1-amine
CID 61490290
2-[2-(2,2,2-Trifluoroethoxy)ethyl]cyclopentan-1-amine
CID 61490905
2-[3-(2,2,2-Trifluoroethoxy)propyl]cyclopentan-1-amine
CID 61491326
2-[2-(2,2,2-Trifluoroethoxy)ethyl]cycloheptan-1-amine
CID 61748888
4-Methyl-7-(2,2,2-trifluoroethoxy)heptan-3-amine
CID 63559791
3-[3-(2,2,2-Trifluoroethoxy)propyl]cycloheptan-1-amine
CID 64503206
2-Methyl-8-(2,2,2-trifluoroethoxy)octan-3-amine
CID 64503225
1-Cyclopropyl-6-(2,2,2-trifluoroethoxy)hexan-1-amine
CID 64504401
N-methyl-3-[3-(2,2,2-trifluoroethoxy)propyl]cyclopentan-1-amine
CID 64505218
3-[3-(2,2,2-Trifluoroethoxy)propyl]cyclohexan-1-amine
CID 64505306

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-(2,2,2-trifluoroethoxy)propan-2-amine?
The IUPAC name of 1-cyclopentyl-3-(2,2,2-trifluoroethoxy)propan-2-amine (CID 103215066) is 1-cyclopentyl-3-(2,2,2-trifluoroethoxy)propan-2-amine.
What is the SMILES notation for 1-cyclopentyl-3-(2,2,2-trifluoroethoxy)propan-2-amine?
The canonical SMILES for 1-cyclopentyl-3-(2,2,2-trifluoroethoxy)propan-2-amine is NC(COCC(F)(F)F)CC1CCCC1.
What is the InChIKey of 1-cyclopentyl-3-(2,2,2-trifluoroethoxy)propan-2-amine?
The InChIKey is MAXHEIZUTBINPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3NO/c11-10(12,13)7-15-6-9(14)5-8-3-1-2-4-8/h8-9H,1-7,14H2.
What are the key properties of 1-cyclopentyl-3-(2,2,2-trifluoroethoxy)propan-2-amine?
1-cyclopentyl-3-(2,2,2-trifluoroethoxy)propan-2-amine has a molecular weight of 225.25 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-(2,2,2-trifluoroethoxy)propan-2-amine is sourced from PubChem (CID 103215066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).