1-cyclopentyl-4-methyl-3-(trifluoromethyl)pyrazol-5-amine

C10H14F3N3 — CID 162574044

IUPAC1-cyclopentyl-4-methyl-3-(trifluoromethyl)pyrazol-5-amine
SMILESCc1c(C(F)(F)F)nn(C2CCCC2)c1N
InChIInChI=1S/C10H14F3N3/c1-6-8(10(11,12)13)15-16(9(6)14)7-4-2-3-5-7/h7H,2-5,14H2,1H3
InChIKeyVFBSKZUSFGJHDR-UHFFFAOYSA-N
MW233.24 g/mol
LogP2.91
Rot. Bonds1

About 1-cyclopentyl-4-methyl-3-(trifluoromethyl)pyrazol-5-amine

1-cyclopentyl-4-methyl-3-(trifluoromethyl)pyrazol-5-amine (PubChem CID 162574044) has the molecular formula C10H14F3N3 and a molecular weight of 233.24 g/mol. Its IUPAC name is 1-cyclopentyl-4-methyl-3-(trifluoromethyl)pyrazol-5-amine.

Molecular Properties

Compound Name1-cyclopentyl-4-methyl-3-(trifluoromethyl)pyrazol-5-amine
PubChem CID162574044
Molecular FormulaC10H14F3N3
Molecular Weight233.24 g/mol
Exact Mass233.11
IUPAC Name1-cyclopentyl-4-methyl-3-(trifluoromethyl)pyrazol-5-amine
SMILESCc1c(C(F)(F)F)nn(C2CCCC2)c1N
InChIInChI=1S/C10H14F3N3/c1-6-8(10(11,12)13)15-16(9(6)14)7-4-2-3-5-7/h7H,2-5,14H2,1H3
InChIKeyVFBSKZUSFGJHDR-UHFFFAOYSA-N
XLogP2.91
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.24
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-4-methyl-3-(trifluoromethyl)pyrazol-5-amine?
The IUPAC name of 1-cyclopentyl-4-methyl-3-(trifluoromethyl)pyrazol-5-amine (CID 162574044) is 1-cyclopentyl-4-methyl-3-(trifluoromethyl)pyrazol-5-amine.
What is the SMILES notation for 1-cyclopentyl-4-methyl-3-(trifluoromethyl)pyrazol-5-amine?
The canonical SMILES for 1-cyclopentyl-4-methyl-3-(trifluoromethyl)pyrazol-5-amine is Cc1c(C(F)(F)F)nn(C2CCCC2)c1N.
What is the InChIKey of 1-cyclopentyl-4-methyl-3-(trifluoromethyl)pyrazol-5-amine?
The InChIKey is VFBSKZUSFGJHDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F3N3/c1-6-8(10(11,12)13)15-16(9(6)14)7-4-2-3-5-7/h7H,2-5,14H2,1H3.
What are the key properties of 1-cyclopentyl-4-methyl-3-(trifluoromethyl)pyrazol-5-amine?
1-cyclopentyl-4-methyl-3-(trifluoromethyl)pyrazol-5-amine has a molecular weight of 233.24 g/mol, XLogP of 2.91, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-4-methyl-3-(trifluoromethyl)pyrazol-5-amine is sourced from PubChem (CID 162574044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).