2-(5-methoxy-2,3-dihydro-1H-inden-4-yl)pyrrolidine

C14H19NO — CID 77131665

IUPAC2-(5-methoxy-2,3-dihydro-1H-inden-4-yl)pyrrolidine
SMILESCOc1ccc2c(c1C1CCCN1)CCC2
InChIInChI=1S/C14H19NO/c1-16-13-8-7-10-4-2-5-11(10)14(13)12-6-3-9-15-12/h7-8,12,15H,2-6,9H2,1H3
InChIKeyUIHWYAFUVAWQJK-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.61
Rot. Bonds2

About 2-(5-methoxy-2,3-dihydro-1H-inden-4-yl)pyrrolidine

2-(5-methoxy-2,3-dihydro-1H-inden-4-yl)pyrrolidine (PubChem CID 77131665) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 2-(5-methoxy-2,3-dihydro-1H-inden-4-yl)pyrrolidine.

Molecular Properties

Compound Name2-(5-methoxy-2,3-dihydro-1H-inden-4-yl)pyrrolidine
PubChem CID77131665
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name2-(5-methoxy-2,3-dihydro-1H-inden-4-yl)pyrrolidine
SMILESCOc1ccc2c(c1C1CCCN1)CCC2
InChIInChI=1S/C14H19NO/c1-16-13-8-7-10-4-2-5-11(10)14(13)12-6-3-9-15-12/h7-8,12,15H,2-6,9H2,1H3
InChIKeyUIHWYAFUVAWQJK-UHFFFAOYSA-N
XLogP2.61
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(2S)-pyrrolidin-2-yl]-2,3-dihydro-1H-inden-5-amine
CID 66518533
N-ethyl-4-[(2S)-pyrrolidin-2-yl]-2,3-dihydro-1H-inden-5-amine
CID 66519183
(2R)-2-(2,3-difluoro-6-methoxyphenyl)pyrrolidine
CID 165345527
2-(2-chloro-3,6-dimethoxyphenyl)piperidine
CID 117392632
2-(2-bromo-6-methoxy-3-methylphenyl)piperidine
CID 84813026
(2S)-2-(2,6-difluoro-3-methoxyphenyl)pyrrolidine;hydrochloride
CID 171196574
2-(2-chloro-3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-4-yl)piperidine
CID 117474234
2-(2,6-dimethoxy-4-methylphenyl)pyrrolidine
CID 130144394
2-(4-methoxy-2,3,6-trimethylphenyl)pyrrolidine
CID 116962291
2-(6-bromo-2-fluoro-3-methoxyphenyl)pyrrolidine
CID 84713802
(2R)-2-(3-fluoro-2-methyl-5,6,7,8-tetrahydronaphthalen-1-yl)pyrrolidine
CID 66519369
3-hydroxy-4-methoxy-2-[(2R)-pyrrolidin-2-yl]benzonitrile
CID 131318832

Frequently Asked Questions

What is the IUPAC name of 2-(5-methoxy-2,3-dihydro-1H-inden-4-yl)pyrrolidine?
The IUPAC name of 2-(5-methoxy-2,3-dihydro-1H-inden-4-yl)pyrrolidine (CID 77131665) is 2-(5-methoxy-2,3-dihydro-1H-inden-4-yl)pyrrolidine.
What is the SMILES notation for 2-(5-methoxy-2,3-dihydro-1H-inden-4-yl)pyrrolidine?
The canonical SMILES for 2-(5-methoxy-2,3-dihydro-1H-inden-4-yl)pyrrolidine is COc1ccc2c(c1C1CCCN1)CCC2.
What is the InChIKey of 2-(5-methoxy-2,3-dihydro-1H-inden-4-yl)pyrrolidine?
The InChIKey is UIHWYAFUVAWQJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-16-13-8-7-10-4-2-5-11(10)14(13)12-6-3-9-15-12/h7-8,12,15H,2-6,9H2,1H3.
What are the key properties of 2-(5-methoxy-2,3-dihydro-1H-inden-4-yl)pyrrolidine?
2-(5-methoxy-2,3-dihydro-1H-inden-4-yl)pyrrolidine has a molecular weight of 217.31 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methoxy-2,3-dihydro-1H-inden-4-yl)pyrrolidine is sourced from PubChem (CID 77131665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).