[1-(methylamino)-3-[3-(trifluoromethyl)pyrazol-1-yl]cyclopentyl]methanol

C11H16F3N3O — CID 79644484

IUPAC[1-(methylamino)-3-[3-(trifluoromethyl)pyrazol-1-yl]cyclopentyl]methanol
SMILESCNC1(CO)CCC(n2ccc(C(F)(F)F)n2)C1
InChIInChI=1S/C11H16F3N3O/c1-15-10(7-18)4-2-8(6-10)17-5-3-9(16-17)11(12,13)14/h3,5,8,15,18H,2,4,6-7H2,1H3
InChIKeyMMTPGIYWIVVUMZ-UHFFFAOYSA-N
MW263.26 g/mol
LogP1.58
Rot. Bonds3

About [1-(methylamino)-3-[3-(trifluoromethyl)pyrazol-1-yl]cyclopentyl]methanol

[1-(methylamino)-3-[3-(trifluoromethyl)pyrazol-1-yl]cyclopentyl]methanol (PubChem CID 79644484) has the molecular formula C11H16F3N3O and a molecular weight of 263.26 g/mol. Its IUPAC name is [1-(methylamino)-3-[3-(trifluoromethyl)pyrazol-1-yl]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(methylamino)-3-[3-(trifluoromethyl)pyrazol-1-yl]cyclopentyl]methanol
PubChem CID79644484
Molecular FormulaC11H16F3N3O
Molecular Weight263.26 g/mol
Exact Mass263.12
IUPAC Name[1-(methylamino)-3-[3-(trifluoromethyl)pyrazol-1-yl]cyclopentyl]methanol
SMILESCNC1(CO)CCC(n2ccc(C(F)(F)F)n2)C1
InChIInChI=1S/C11H16F3N3O/c1-15-10(7-18)4-2-8(6-10)17-5-3-9(16-17)11(12,13)14/h3,5,8,15,18H,2,4,6-7H2,1H3
InChIKeyMMTPGIYWIVVUMZ-UHFFFAOYSA-N
XLogP1.58
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.26
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-(methylamino)-3-[3-(trifluoromethyl)pyrazol-1-yl]cyclopentyl]methanol?
The IUPAC name of [1-(methylamino)-3-[3-(trifluoromethyl)pyrazol-1-yl]cyclopentyl]methanol (CID 79644484) is [1-(methylamino)-3-[3-(trifluoromethyl)pyrazol-1-yl]cyclopentyl]methanol.
What is the SMILES notation for [1-(methylamino)-3-[3-(trifluoromethyl)pyrazol-1-yl]cyclopentyl]methanol?
The canonical SMILES for [1-(methylamino)-3-[3-(trifluoromethyl)pyrazol-1-yl]cyclopentyl]methanol is CNC1(CO)CCC(n2ccc(C(F)(F)F)n2)C1.
What is the InChIKey of [1-(methylamino)-3-[3-(trifluoromethyl)pyrazol-1-yl]cyclopentyl]methanol?
The InChIKey is MMTPGIYWIVVUMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16F3N3O/c1-15-10(7-18)4-2-8(6-10)17-5-3-9(16-17)11(12,13)14/h3,5,8,15,18H,2,4,6-7H2,1H3.
What are the key properties of [1-(methylamino)-3-[3-(trifluoromethyl)pyrazol-1-yl]cyclopentyl]methanol?
[1-(methylamino)-3-[3-(trifluoromethyl)pyrazol-1-yl]cyclopentyl]methanol has a molecular weight of 263.26 g/mol, XLogP of 1.58, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(methylamino)-3-[3-(trifluoromethyl)pyrazol-1-yl]cyclopentyl]methanol is sourced from PubChem (CID 79644484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).