1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-amine

C11H14F2N2O — CID 43315583

IUPAC1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-amine
SMILESNC1CCN(c2ccccc2OC(F)F)C1
InChIInChI=1S/C11H14F2N2O/c12-11(13)16-10-4-2-1-3-9(10)15-6-5-8(14)7-15/h1-4,8,11H,5-7,14H2
InChIKeyYOGNIRLYJFDRBP-UHFFFAOYSA-N
MW228.24 g/mol
LogP1.83
Rot. Bonds3

About 1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-amine

1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-amine (PubChem CID 43315583) has the molecular formula C11H14F2N2O and a molecular weight of 228.24 g/mol. Its IUPAC name is 1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-amine.

Molecular Properties

Compound Name1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-amine
PubChem CID43315583
Molecular FormulaC11H14F2N2O
Molecular Weight228.24 g/mol
Exact Mass228.11
IUPAC Name1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-amine
SMILESNC1CCN(c2ccccc2OC(F)F)C1
InChIInChI=1S/C11H14F2N2O/c12-11(13)16-10-4-2-1-3-9(10)15-6-5-8(14)7-15/h1-4,8,11H,5-7,14H2
InChIKeyYOGNIRLYJFDRBP-UHFFFAOYSA-N
XLogP1.83
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.24
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[2-(difluoromethoxy)phenyl]pyrrolidin-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

Related Compounds

2-[(3R)-3-aminopyrrolidin-1-yl]benzonitrile
CID 94340791
1-(2-propan-2-yloxyphenyl)azetidin-3-amine
CID 117002832
N-[1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-yl]furan-2-carboxamide
CID 56791669
N-[(3S)-1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-yl]furan-2-carboxamide
CID 95629122
(3S)-1-(2-bromophenyl)pyrrolidin-3-amine
CID 51663672
3-butan-2-yl-1-[2-(difluoromethoxy)phenyl]piperazine
CID 64925822
1-(2-methoxyphenyl)piperidin-4-amine
CID 24708477
N-[1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-yl]-3-methylquinoxalin-2-amine
CID 102557441
1-cyclopropyl-3-[1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-yl]-2-ethylguanidine
CID 111921537
N-[1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-yl]-2,2-dimethylcyclopropane-1-carboxamide
CID 91646113
7-amino-N-[1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-yl]heptanamide;dihydrochloride
CID 119882877
1-[2-(3-fluoropropoxy)phenyl]piperidin-3-amine
CID 81113423

Frequently Asked Questions

What is the IUPAC name of 1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-amine?
The IUPAC name of 1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-amine (CID 43315583) is 1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-amine.
What is the SMILES notation for 1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-amine?
The canonical SMILES for 1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-amine is NC1CCN(c2ccccc2OC(F)F)C1.
What is the InChIKey of 1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-amine?
The InChIKey is YOGNIRLYJFDRBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F2N2O/c12-11(13)16-10-4-2-1-3-9(10)15-6-5-8(14)7-15/h1-4,8,11H,5-7,14H2.
What are the key properties of 1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-amine?
1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-amine has a molecular weight of 228.24 g/mol, XLogP of 1.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-amine is sourced from PubChem (CID 43315583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).