(3R)-N-[1-(fluoromethyl)cyclopropyl]-1-propan-2-ylpyrrolidin-3-amine

C11H21FN2 — CID 177078775

IUPAC(3R)-N-[1-(fluoromethyl)cyclopropyl]-1-propan-2-ylpyrrolidin-3-amine
SMILESCC(C)N1CC[C@@H](NC2(CF)CC2)C1
InChIInChI=1S/C11H21FN2/c1-9(2)14-6-3-10(7-14)13-11(8-12)4-5-11/h9-10,13H,3-8H2,1-2H3/t10-/m1/s1
InChIKeyXMOBQWRQPHTOCT-SNVBAGLBSA-N
MW200.30 g/mol
LogP1.56
Rot. Bonds4

About (3R)-N-[1-(fluoromethyl)cyclopropyl]-1-propan-2-ylpyrrolidin-3-amine

(3R)-N-[1-(fluoromethyl)cyclopropyl]-1-propan-2-ylpyrrolidin-3-amine (PubChem CID 177078775) has the molecular formula C11H21FN2 and a molecular weight of 200.30 g/mol. Its IUPAC name is (3R)-N-[1-(fluoromethyl)cyclopropyl]-1-propan-2-ylpyrrolidin-3-amine.

Molecular Properties

Compound Name(3R)-N-[1-(fluoromethyl)cyclopropyl]-1-propan-2-ylpyrrolidin-3-amine
PubChem CID177078775
Molecular FormulaC11H21FN2
Molecular Weight200.30 g/mol
Exact Mass200.17
IUPAC Name(3R)-N-[1-(fluoromethyl)cyclopropyl]-1-propan-2-ylpyrrolidin-3-amine
SMILESCC(C)N1CC[C@@H](NC2(CF)CC2)C1
InChIInChI=1S/C11H21FN2/c1-9(2)14-6-3-10(7-14)13-11(8-12)4-5-11/h9-10,13H,3-8H2,1-2H3/t10-/m1/s1
InChIKeyXMOBQWRQPHTOCT-SNVBAGLBSA-N
XLogP1.56
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.30
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3R)-N-[1-(fluoromethyl)cyclopropyl]-1-propan-2-ylpyrrolidin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3R)-N-[1-(fluoromethyl)cyclopropyl]-1-propan-2-ylpyrrolidin-3-amine?
The IUPAC name of (3R)-N-[1-(fluoromethyl)cyclopropyl]-1-propan-2-ylpyrrolidin-3-amine (CID 177078775) is (3R)-N-[1-(fluoromethyl)cyclopropyl]-1-propan-2-ylpyrrolidin-3-amine.
What is the SMILES notation for (3R)-N-[1-(fluoromethyl)cyclopropyl]-1-propan-2-ylpyrrolidin-3-amine?
The canonical SMILES for (3R)-N-[1-(fluoromethyl)cyclopropyl]-1-propan-2-ylpyrrolidin-3-amine is CC(C)N1CC[C@@H](NC2(CF)CC2)C1.
What is the InChIKey of (3R)-N-[1-(fluoromethyl)cyclopropyl]-1-propan-2-ylpyrrolidin-3-amine?
The InChIKey is XMOBQWRQPHTOCT-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H21FN2/c1-9(2)14-6-3-10(7-14)13-11(8-12)4-5-11/h9-10,13H,3-8H2,1-2H3/t10-/m1/s1.
What are the key properties of (3R)-N-[1-(fluoromethyl)cyclopropyl]-1-propan-2-ylpyrrolidin-3-amine?
(3R)-N-[1-(fluoromethyl)cyclopropyl]-1-propan-2-ylpyrrolidin-3-amine has a molecular weight of 200.30 g/mol, XLogP of 1.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[1-(fluoromethyl)cyclopropyl]-1-propan-2-ylpyrrolidin-3-amine is sourced from PubChem (CID 177078775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).