cis-(1R,3R)-3-amino-1-(trifluoromethyl)cyclopentane-1-carboxylic acid

C7H10F3NO2 — CID 124633428

IUPACcis-(1R,3R)-3-amino-1-(trifluoromethyl)cyclopentane-1-carboxylic acid
SMILESN[C@@H]1CC[C@@](C(=O)O)(C(F)(F)F)C1
InChIInChI=1S/C7H10F3NO2/c8-7(9,10)6(5(12)13)2-1-4(11)3-6/h4H,1-3,11H2,(H,12,13)/t4-,6-/m1/s1
InChIKeySVQQXTBSFULKOT-INEUFUBQSA-N
MW197.16 g/mol
LogP1.13
Rot. Bonds1

About cis-(1R,3R)-3-amino-1-(trifluoromethyl)cyclopentane-1-carboxylic acid

cis-(1R,3R)-3-amino-1-(trifluoromethyl)cyclopentane-1-carboxylic acid (PubChem CID 124633428) has the molecular formula C7H10F3NO2 and a molecular weight of 197.16 g/mol. Its IUPAC name is cis-(1R,3R)-3-amino-1-(trifluoromethyl)cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Namecis-(1R,3R)-3-amino-1-(trifluoromethyl)cyclopentane-1-carboxylic acid
PubChem CID124633428
Molecular FormulaC7H10F3NO2
Molecular Weight197.16 g/mol
Exact Mass197.07
IUPAC Namecis-(1R,3R)-3-amino-1-(trifluoromethyl)cyclopentane-1-carboxylic acid
SMILESN[C@@H]1CC[C@@](C(=O)O)(C(F)(F)F)C1
InChIInChI=1S/C7H10F3NO2/c8-7(9,10)6(5(12)13)2-1-4(11)3-6/h4H,1-3,11H2,(H,12,13)/t4-,6-/m1/s1
InChIKeySVQQXTBSFULKOT-INEUFUBQSA-N
XLogP1.13
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.16
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cis-(1R,3R)-3-amino-1-(trifluoromethyl)cyclopentane-1-carboxylic acid?
The IUPAC name of cis-(1R,3R)-3-amino-1-(trifluoromethyl)cyclopentane-1-carboxylic acid (CID 124633428) is cis-(1R,3R)-3-amino-1-(trifluoromethyl)cyclopentane-1-carboxylic acid.
What is the SMILES notation for cis-(1R,3R)-3-amino-1-(trifluoromethyl)cyclopentane-1-carboxylic acid?
The canonical SMILES for cis-(1R,3R)-3-amino-1-(trifluoromethyl)cyclopentane-1-carboxylic acid is N[C@@H]1CC[C@@](C(=O)O)(C(F)(F)F)C1.
What is the InChIKey of cis-(1R,3R)-3-amino-1-(trifluoromethyl)cyclopentane-1-carboxylic acid?
The InChIKey is SVQQXTBSFULKOT-INEUFUBQSA-N. The full InChI is InChI=1S/C7H10F3NO2/c8-7(9,10)6(5(12)13)2-1-4(11)3-6/h4H,1-3,11H2,(H,12,13)/t4-,6-/m1/s1.
What are the key properties of cis-(1R,3R)-3-amino-1-(trifluoromethyl)cyclopentane-1-carboxylic acid?
cis-(1R,3R)-3-amino-1-(trifluoromethyl)cyclopentane-1-carboxylic acid has a molecular weight of 197.16 g/mol, XLogP of 1.13, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,3R)-3-amino-1-(trifluoromethyl)cyclopentane-1-carboxylic acid is sourced from PubChem (CID 124633428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).