2-(2-chlorofuran-3-yl)-2-methylpyrrolidine

C9H12ClNO — CID 82655515

IUPAC2-(2-chlorofuran-3-yl)-2-methylpyrrolidine
SMILESCC1(c2ccoc2Cl)CCCN1
InChIInChI=1S/C9H12ClNO/c1-9(4-2-5-11-9)7-3-6-12-8(7)10/h3,6,11H,2,4-5H2,1H3
InChIKeyQPHDZQMALYLNJV-UHFFFAOYSA-N
MW185.65 g/mol
LogP2.53
Rot. Bonds1

About 2-(2-chlorofuran-3-yl)-2-methylpyrrolidine

2-(2-chlorofuran-3-yl)-2-methylpyrrolidine (PubChem CID 82655515) has the molecular formula C9H12ClNO and a molecular weight of 185.65 g/mol. Its IUPAC name is 2-(2-chlorofuran-3-yl)-2-methylpyrrolidine.

Molecular Properties

Compound Name2-(2-chlorofuran-3-yl)-2-methylpyrrolidine
PubChem CID82655515
Molecular FormulaC9H12ClNO
Molecular Weight185.65 g/mol
Exact Mass185.06
IUPAC Name2-(2-chlorofuran-3-yl)-2-methylpyrrolidine
SMILESCC1(c2ccoc2Cl)CCCN1
InChIInChI=1S/C9H12ClNO/c1-9(4-2-5-11-9)7-3-6-12-8(7)10/h3,6,11H,2,4-5H2,1H3
InChIKeyQPHDZQMALYLNJV-UHFFFAOYSA-N
XLogP2.53
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.65
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chloro-3-methylphenyl)-2-methylpyrrolidine
CID 117299724
2-(2-chloro-4-methylphenyl)-2-methylpyrrolidine
CID 117299721
7-chloro-4-(2-methylpyrrolidin-2-yl)quinoline
CID 20977046
2-(2-chloro-3,5-difluorophenyl)-2-methylpyrrolidine
CID 117335365
2-(5-chloro-2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpyrrolidine
CID 117387306
2-(4-chloro-2,3-dimethoxyphenyl)-2-methylpyrrolidine
CID 117392452
2-(6-chloro-2,2-dimethyl-1,3-benzodioxol-5-yl)-2-methylpyrrolidine
CID 117423013
6-chloro-2,3-difluoro-4-(2-methylpyrrolidin-2-yl)phenol
CID 117372312
2-(4-bromo-2-chloro-3-fluorophenyl)-2-methylpyrrolidine
CID 117472518
2-(2-bromophenyl)-2-methylpyrrolidine
CID 82621906
2-(furan-3-yl)-2-methylpyrrolidine
CID 66465313
2-(6-chloro-1,3-benzodioxol-4-yl)-2-methylpyrrolidine
CID 117351983

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorofuran-3-yl)-2-methylpyrrolidine?
The IUPAC name of 2-(2-chlorofuran-3-yl)-2-methylpyrrolidine (CID 82655515) is 2-(2-chlorofuran-3-yl)-2-methylpyrrolidine.
What is the SMILES notation for 2-(2-chlorofuran-3-yl)-2-methylpyrrolidine?
The canonical SMILES for 2-(2-chlorofuran-3-yl)-2-methylpyrrolidine is CC1(c2ccoc2Cl)CCCN1.
What is the InChIKey of 2-(2-chlorofuran-3-yl)-2-methylpyrrolidine?
The InChIKey is QPHDZQMALYLNJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12ClNO/c1-9(4-2-5-11-9)7-3-6-12-8(7)10/h3,6,11H,2,4-5H2,1H3.
What are the key properties of 2-(2-chlorofuran-3-yl)-2-methylpyrrolidine?
2-(2-chlorofuran-3-yl)-2-methylpyrrolidine has a molecular weight of 185.65 g/mol, XLogP of 2.53, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorofuran-3-yl)-2-methylpyrrolidine is sourced from PubChem (CID 82655515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).