4-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidin-3-amine

C10H19F3N2 — CID 81460086

IUPAC4-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidin-3-amine
SMILESCC1CNCC1N(CC(F)(F)F)C(C)C
InChIInChI=1S/C10H19F3N2/c1-7(2)15(6-10(11,12)13)9-5-14-4-8(9)3/h7-9,14H,4-6H2,1-3H3
InChIKeyIQPOWEVTTAFAJZ-UHFFFAOYSA-N
MW224.27 g/mol
LogP1.87
Rot. Bonds3

About 4-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidin-3-amine

4-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidin-3-amine (PubChem CID 81460086) has the molecular formula C10H19F3N2 and a molecular weight of 224.27 g/mol. Its IUPAC name is 4-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name4-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidin-3-amine
PubChem CID81460086
Molecular FormulaC10H19F3N2
Molecular Weight224.27 g/mol
Exact Mass224.15
IUPAC Name4-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidin-3-amine
SMILESCC1CNCC1N(CC(F)(F)F)C(C)C
InChIInChI=1S/C10H19F3N2/c1-7(2)15(6-10(11,12)13)9-5-14-4-8(9)3/h7-9,14H,4-6H2,1-3H3
InChIKeyIQPOWEVTTAFAJZ-UHFFFAOYSA-N
XLogP1.87
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.27
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidin-3-amine?
The IUPAC name of 4-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidin-3-amine (CID 81460086) is 4-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidin-3-amine.
What is the SMILES notation for 4-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidin-3-amine?
The canonical SMILES for 4-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidin-3-amine is CC1CNCC1N(CC(F)(F)F)C(C)C.
What is the InChIKey of 4-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidin-3-amine?
The InChIKey is IQPOWEVTTAFAJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3N2/c1-7(2)15(6-10(11,12)13)9-5-14-4-8(9)3/h7-9,14H,4-6H2,1-3H3.
What are the key properties of 4-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidin-3-amine?
4-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidin-3-amine has a molecular weight of 224.27 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyrrolidin-3-amine is sourced from PubChem (CID 81460086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).