1-cyclopropyl-N-(2,4-difluorophenyl)pyrrolidin-3-amine

C13H16F2N2 — CID 55139840

IUPAC1-cyclopropyl-N-(2,4-difluorophenyl)pyrrolidin-3-amine
SMILESFc1ccc(NC2CCN(C3CC3)C2)c(F)c1
InChIInChI=1S/C13H16F2N2/c14-9-1-4-13(12(15)7-9)16-10-5-6-17(8-10)11-2-3-11/h1,4,7,10-11,16H,2-3,5-6,8H2
InChIKeyIUXCTPADTUQKAX-UHFFFAOYSA-N
MW238.28 g/mol
LogP2.61
Rot. Bonds3

About 1-cyclopropyl-N-(2,4-difluorophenyl)pyrrolidin-3-amine

1-cyclopropyl-N-(2,4-difluorophenyl)pyrrolidin-3-amine (PubChem CID 55139840) has the molecular formula C13H16F2N2 and a molecular weight of 238.28 g/mol. Its IUPAC name is 1-cyclopropyl-N-(2,4-difluorophenyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-(2,4-difluorophenyl)pyrrolidin-3-amine
PubChem CID55139840
Molecular FormulaC13H16F2N2
Molecular Weight238.28 g/mol
Exact Mass238.13
IUPAC Name1-cyclopropyl-N-(2,4-difluorophenyl)pyrrolidin-3-amine
SMILESFc1ccc(NC2CCN(C3CC3)C2)c(F)c1
InChIInChI=1S/C13H16F2N2/c14-9-1-4-13(12(15)7-9)16-10-5-6-17(8-10)11-2-3-11/h1,4,7,10-11,16H,2-3,5-6,8H2
InChIKeyIUXCTPADTUQKAX-UHFFFAOYSA-N
XLogP2.61
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.28
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-cyclopropyl-N-(2,4-difluorophenyl)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

1-cyclopropyl-N-(2,3,5,6-tetrafluorophenyl)pyrrolidin-3-amine
CID 107643590
1-cyclopropyl-N-(2,6-difluorophenyl)pyrrolidin-3-amine
CID 62983179
1-N-(1-cyclopropylpyrrolidin-3-yl)-4-fluoro-5-methylbenzene-1,2-diamine
CID 103590220
N-(2,4-difluorophenyl)pyrrolidin-3-amine
CID 66545630
N-(2,4-difluorophenyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 82853708
1-cyclopropyl-N-(3-fluoro-5-methylphenyl)pyrrolidin-3-amine
CID 79055593
N-(4-bromo-2,3-dichlorophenyl)-1-cyclopropylpyrrolidin-3-amine
CID 107788003
4-chloro-2-[(1-cyclopropylpyrrolidin-3-yl)amino]benzoic acid
CID 63081661
4-(2,4-difluoroanilino)-N,N-dimethylpiperidine-1-carboxamide
CID 83262257
2-amino-N-(1-cyclopropylpyrrolidin-3-yl)-4-fluorobenzamide
CID 63110384
N-(2-fluoro-4-methylphenyl)-1-methylpyrrolidin-3-amine
CID 62976143
2-[1-[(1-cyclopropylpyrrolidin-3-yl)amino]ethyl]-5-fluorophenol
CID 63068697

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-(2,4-difluorophenyl)pyrrolidin-3-amine?
The IUPAC name of 1-cyclopropyl-N-(2,4-difluorophenyl)pyrrolidin-3-amine (CID 55139840) is 1-cyclopropyl-N-(2,4-difluorophenyl)pyrrolidin-3-amine.
What is the SMILES notation for 1-cyclopropyl-N-(2,4-difluorophenyl)pyrrolidin-3-amine?
The canonical SMILES for 1-cyclopropyl-N-(2,4-difluorophenyl)pyrrolidin-3-amine is Fc1ccc(NC2CCN(C3CC3)C2)c(F)c1.
What is the InChIKey of 1-cyclopropyl-N-(2,4-difluorophenyl)pyrrolidin-3-amine?
The InChIKey is IUXCTPADTUQKAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16F2N2/c14-9-1-4-13(12(15)7-9)16-10-5-6-17(8-10)11-2-3-11/h1,4,7,10-11,16H,2-3,5-6,8H2.
What are the key properties of 1-cyclopropyl-N-(2,4-difluorophenyl)pyrrolidin-3-amine?
1-cyclopropyl-N-(2,4-difluorophenyl)pyrrolidin-3-amine has a molecular weight of 238.28 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-(2,4-difluorophenyl)pyrrolidin-3-amine is sourced from PubChem (CID 55139840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).