N-methyl-3-[4-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-amine

C10H14F3N3 — CID 79643708

IUPACN-methyl-3-[4-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-amine
SMILESCNC1CCC(n2cc(C(F)(F)F)cn2)C1
InChIInChI=1S/C10H14F3N3/c1-14-8-2-3-9(4-8)16-6-7(5-15-16)10(11,12)13/h5-6,8-9,14H,2-4H2,1H3
InChIKeyUFSAWQAYUBCQGM-UHFFFAOYSA-N
MW233.24 g/mol
LogP2.21
Rot. Bonds2

About N-methyl-3-[4-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-amine

N-methyl-3-[4-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-amine (PubChem CID 79643708) has the molecular formula C10H14F3N3 and a molecular weight of 233.24 g/mol. Its IUPAC name is N-methyl-3-[4-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-amine.

Molecular Properties

Compound NameN-methyl-3-[4-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-amine
PubChem CID79643708
Molecular FormulaC10H14F3N3
Molecular Weight233.24 g/mol
Exact Mass233.11
IUPAC NameN-methyl-3-[4-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-amine
SMILESCNC1CCC(n2cc(C(F)(F)F)cn2)C1
InChIInChI=1S/C10H14F3N3/c1-14-8-2-3-9(4-8)16-6-7(5-15-16)10(11,12)13/h5-6,8-9,14H,2-4H2,1H3
InChIKeyUFSAWQAYUBCQGM-UHFFFAOYSA-N
XLogP2.21
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.24
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[4-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-amine?
The IUPAC name of N-methyl-3-[4-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-amine (CID 79643708) is N-methyl-3-[4-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-amine.
What is the SMILES notation for N-methyl-3-[4-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-amine?
The canonical SMILES for N-methyl-3-[4-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-amine is CNC1CCC(n2cc(C(F)(F)F)cn2)C1.
What is the InChIKey of N-methyl-3-[4-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-amine?
The InChIKey is UFSAWQAYUBCQGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F3N3/c1-14-8-2-3-9(4-8)16-6-7(5-15-16)10(11,12)13/h5-6,8-9,14H,2-4H2,1H3.
What are the key properties of N-methyl-3-[4-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-amine?
N-methyl-3-[4-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-amine has a molecular weight of 233.24 g/mol, XLogP of 2.21, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[4-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-amine is sourced from PubChem (CID 79643708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).