2-(2,3-dichlorophenyl)-3-methylpyrrolidine

C11H13Cl2N — CID 3523837

IUPAC2-(2,3-dichlorophenyl)-3-methylpyrrolidine
SMILESCC1CCNC1c1cccc(Cl)c1Cl
InChIInChI=1S/C11H13Cl2N/c1-7-5-6-14-11(7)8-3-2-4-9(12)10(8)13/h2-4,7,11,14H,5-6H2,1H3
InChIKeyFCTVGMJOUKWMOA-UHFFFAOYSA-N
MW230.14 g/mol
LogP3.66
Rot. Bonds1

About 2-(2,3-dichlorophenyl)-3-methylpyrrolidine

2-(2,3-dichlorophenyl)-3-methylpyrrolidine (PubChem CID 3523837) has the molecular formula C11H13Cl2N and a molecular weight of 230.14 g/mol. Its IUPAC name is 2-(2,3-dichlorophenyl)-3-methylpyrrolidine.

Molecular Properties

Compound Name2-(2,3-dichlorophenyl)-3-methylpyrrolidine
PubChem CID3523837
Molecular FormulaC11H13Cl2N
Molecular Weight230.14 g/mol
Exact Mass229.04
IUPAC Name2-(2,3-dichlorophenyl)-3-methylpyrrolidine
SMILESCC1CCNC1c1cccc(Cl)c1Cl
InChIInChI=1S/C11H13Cl2N/c1-7-5-6-14-11(7)8-3-2-4-9(12)10(8)13/h2-4,7,11,14H,5-6H2,1H3
InChIKeyFCTVGMJOUKWMOA-UHFFFAOYSA-N
XLogP3.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.14
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

7-chloro-2-(3-methylpyrrolidin-2-yl)-1,3-benzothiazole
CID 102780700
1-(2,3-dichlorophenyl)-2,3,4,5,6,7,8,8a-octahydro-1H-isoquinolin-4a-ol
CID 6456030
2-(2,2-dimethyl-3H-1-benzofuran-7-yl)-3-methylpyrrolidine
CID 64686696
ethane;3-methyl-2-phenylpyrrolidine
CID 162762531
2-(2,6-dimethoxyphenyl)-3-methylpyrrolidine
CID 3362544
(2,3-dichlorophenyl)cycloheptane
CID 166869288
(1R)-4-chloro-1-methyl-2,3-dihydro-1H-isoindole
CID 131080602
2-(3-fluorophenyl)-3-methylpyrrolidine
CID 3582862
3-(2,3-dichlorophenyl)piperidine
CID 24904244
2-(2,3-dichlorophenyl)-N-(2-methylpiperidin-4-yl)cyclopropane-1-carboxamide;hydrochloride
CID 120599119
2-(2,3-dichlorophenyl)-1,3-thiazinane
CID 66220231
(2S,3S)-2-(4-fluorophenyl)-3-methylpyrrolidine
CID 82409458

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dichlorophenyl)-3-methylpyrrolidine?
The IUPAC name of 2-(2,3-dichlorophenyl)-3-methylpyrrolidine (CID 3523837) is 2-(2,3-dichlorophenyl)-3-methylpyrrolidine.
What is the SMILES notation for 2-(2,3-dichlorophenyl)-3-methylpyrrolidine?
The canonical SMILES for 2-(2,3-dichlorophenyl)-3-methylpyrrolidine is CC1CCNC1c1cccc(Cl)c1Cl.
What is the InChIKey of 2-(2,3-dichlorophenyl)-3-methylpyrrolidine?
The InChIKey is FCTVGMJOUKWMOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13Cl2N/c1-7-5-6-14-11(7)8-3-2-4-9(12)10(8)13/h2-4,7,11,14H,5-6H2,1H3.
What are the key properties of 2-(2,3-dichlorophenyl)-3-methylpyrrolidine?
2-(2,3-dichlorophenyl)-3-methylpyrrolidine has a molecular weight of 230.14 g/mol, XLogP of 3.66, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dichlorophenyl)-3-methylpyrrolidine is sourced from PubChem (CID 3523837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).