(4R)-4-(3-chlorophenyl)-3,3-diethylpyrrolidine

C14H20ClN — CID 125451105

IUPAC(4R)-4-(3-chlorophenyl)-3,3-diethylpyrrolidine
SMILESCCC1(CC)CNC[C@@H]1c1cccc(Cl)c1
InChIInChI=1S/C14H20ClN/c1-3-14(4-2)10-16-9-13(14)11-6-5-7-12(15)8-11/h5-8,13,16H,3-4,9-10H2,1-2H3/t13-/m1/s1
InChIKeyXCWDTGAOXDTEDK-CYBMUJFWSA-N
MW237.77 g/mol
LogP3.83
Rot. Bonds3

About (4R)-4-(3-chlorophenyl)-3,3-diethylpyrrolidine

(4R)-4-(3-chlorophenyl)-3,3-diethylpyrrolidine (PubChem CID 125451105) has the molecular formula C14H20ClN and a molecular weight of 237.77 g/mol. Its IUPAC name is (4R)-4-(3-chlorophenyl)-3,3-diethylpyrrolidine.

Molecular Properties

Compound Name(4R)-4-(3-chlorophenyl)-3,3-diethylpyrrolidine
PubChem CID125451105
Molecular FormulaC14H20ClN
Molecular Weight237.77 g/mol
Exact Mass237.13
IUPAC Name(4R)-4-(3-chlorophenyl)-3,3-diethylpyrrolidine
SMILESCCC1(CC)CNC[C@@H]1c1cccc(Cl)c1
InChIInChI=1S/C14H20ClN/c1-3-14(4-2)10-16-9-13(14)11-6-5-7-12(15)8-11/h5-8,13,16H,3-4,9-10H2,1-2H3/t13-/m1/s1
InChIKeyXCWDTGAOXDTEDK-CYBMUJFWSA-N
XLogP3.83
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.77
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (4R)-4-(3-chlorophenyl)-3,3-diethylpyrrolidine 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

(4S)-3,3-diethyl-4-(3-methylphenyl)pyrrolidine
CID 125450470
3-(3-chlorophenyl)-4,4-dipropylpiperidine
CID 79432544
(3S,4R)-3-(3-chlorophenyl)-4-ethylpyrrolidine
CID 125451676
3-(3-bromophenyl)-4,4-diethylpiperidine
CID 79433788
2-[(3S)-4,4-diethylpyrrolidin-3-yl]phenol
CID 125450658
5-(3-chlorophenyl)-9-ethyl-3-azaspiro[5.6]dodecane
CID 79430330
3-(3-chlorophenyl)azetidine;hydrochloride
CID 72698856
(3S,4R)-3-(3-chlorophenyl)-4-propylpyrrolidine
CID 125452847
3-(3-chlorophenyl)-4-ethyl-4-(methoxymethyl)piperidine-2,6-dione
CID 79432286
[2-(3-chlorophenyl)-1-methylcyclopropyl]methanol
CID 139784418
4-(3-chlorophenyl)-3-propylpiperidine
CID 79321401
2-(3-chlorophenyl)-3,5,5-trimethylmorpholine
CID 43366940

Frequently Asked Questions

What is the IUPAC name of (4R)-4-(3-chlorophenyl)-3,3-diethylpyrrolidine?
The IUPAC name of (4R)-4-(3-chlorophenyl)-3,3-diethylpyrrolidine (CID 125451105) is (4R)-4-(3-chlorophenyl)-3,3-diethylpyrrolidine.
What is the SMILES notation for (4R)-4-(3-chlorophenyl)-3,3-diethylpyrrolidine?
The canonical SMILES for (4R)-4-(3-chlorophenyl)-3,3-diethylpyrrolidine is CCC1(CC)CNC[C@@H]1c1cccc(Cl)c1.
What is the InChIKey of (4R)-4-(3-chlorophenyl)-3,3-diethylpyrrolidine?
The InChIKey is XCWDTGAOXDTEDK-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H20ClN/c1-3-14(4-2)10-16-9-13(14)11-6-5-7-12(15)8-11/h5-8,13,16H,3-4,9-10H2,1-2H3/t13-/m1/s1.
What are the key properties of (4R)-4-(3-chlorophenyl)-3,3-diethylpyrrolidine?
(4R)-4-(3-chlorophenyl)-3,3-diethylpyrrolidine has a molecular weight of 237.77 g/mol, XLogP of 3.83, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(3-chlorophenyl)-3,3-diethylpyrrolidine is sourced from PubChem (CID 125451105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).