2-[1-(4-methoxyphenyl)cyclopropyl]pyrrolidine

C14H19NO — CID 83910096

IUPAC2-[1-(4-methoxyphenyl)cyclopropyl]pyrrolidine
SMILESCOc1ccc(C2(C3CCCN3)CC2)cc1
InChIInChI=1S/C14H19NO/c1-16-12-6-4-11(5-7-12)14(8-9-14)13-3-2-10-15-13/h4-7,13,15H,2-3,8-10H2,1H3
InChIKeyPZQMITSEIKLJQS-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.48
Rot. Bonds3

About 2-[1-(4-methoxyphenyl)cyclopropyl]pyrrolidine

2-[1-(4-methoxyphenyl)cyclopropyl]pyrrolidine (PubChem CID 83910096) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 2-[1-(4-methoxyphenyl)cyclopropyl]pyrrolidine.

Molecular Properties

Compound Name2-[1-(4-methoxyphenyl)cyclopropyl]pyrrolidine
PubChem CID83910096
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name2-[1-(4-methoxyphenyl)cyclopropyl]pyrrolidine
SMILESCOc1ccc(C2(C3CCCN3)CC2)cc1
InChIInChI=1S/C14H19NO/c1-16-12-6-4-11(5-7-12)14(8-9-14)13-3-2-10-15-13/h4-7,13,15H,2-3,8-10H2,1H3
InChIKeyPZQMITSEIKLJQS-UHFFFAOYSA-N
XLogP2.48
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(4-bromophenyl)cyclopropyl]pyrrolidine
CID 83913427
3a-(3,4-dimethoxyphenyl)-1,2,3,4,5,6,7,7a-octahydroindole
CID 85196191
6-methoxy-1-pyrrolidin-2-yl-2,3-dihydroinden-1-ol
CID 79375065
4a-phenyl-2,3,4,5,6,7,8,8a-octahydro-1H-quinoline
CID 71741959
2-[1-(5-methylfuran-2-yl)cyclopropyl]pyrrolidine
CID 112714948
2-[1-(2,4-dimethylphenyl)cyclopropyl]pyrrolidine
CID 83909979
2-(4-methoxyphenyl)-2-methylpiperidin-3-ol
CID 115032686
2-(1-thiophen-2-ylcyclopropyl)pyrrolidine
CID 83907665
3-(1-pyrrolidin-2-ylcyclohexyl)pyridine
CID 83911588
2-[2-(4-methoxyphenyl)piperidin-3-yl]propan-2-ol;hydrochloride
CID 21436294
ethane;(4-methoxyphenyl)-pyrrolidin-2-ylmethanol
CID 142507524
1-methoxy-4-phenoxybenzene;2-methylpiperidine
CID 143435374

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-methoxyphenyl)cyclopropyl]pyrrolidine?
The IUPAC name of 2-[1-(4-methoxyphenyl)cyclopropyl]pyrrolidine (CID 83910096) is 2-[1-(4-methoxyphenyl)cyclopropyl]pyrrolidine.
What is the SMILES notation for 2-[1-(4-methoxyphenyl)cyclopropyl]pyrrolidine?
The canonical SMILES for 2-[1-(4-methoxyphenyl)cyclopropyl]pyrrolidine is COc1ccc(C2(C3CCCN3)CC2)cc1.
What is the InChIKey of 2-[1-(4-methoxyphenyl)cyclopropyl]pyrrolidine?
The InChIKey is PZQMITSEIKLJQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-16-12-6-4-11(5-7-12)14(8-9-14)13-3-2-10-15-13/h4-7,13,15H,2-3,8-10H2,1H3.
What are the key properties of 2-[1-(4-methoxyphenyl)cyclopropyl]pyrrolidine?
2-[1-(4-methoxyphenyl)cyclopropyl]pyrrolidine has a molecular weight of 217.31 g/mol, XLogP of 2.48, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-methoxyphenyl)cyclopropyl]pyrrolidine is sourced from PubChem (CID 83910096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).