4-methoxy-7-[(2R)-pyrrolidin-2-yl]-2,3-dihydro-1H-inden-5-ol

C14H19NO2 — CID 66519356

IUPAC4-methoxy-7-[(2R)-pyrrolidin-2-yl]-2,3-dihydro-1H-inden-5-ol
SMILESCOc1c(O)cc([C@H]2CCCN2)c2c1CCC2
InChIInChI=1S/C14H19NO2/c1-17-14-10-5-2-4-9(10)11(8-13(14)16)12-6-3-7-15-12/h8,12,15-16H,2-7H2,1H3/t12-/m1/s1
InChIKeyWDZZMJIKARGPNO-GFCCVEGCSA-N
MW233.31 g/mol
LogP2.31
Rot. Bonds2

About 4-methoxy-7-[(2R)-pyrrolidin-2-yl]-2,3-dihydro-1H-inden-5-ol

4-methoxy-7-[(2R)-pyrrolidin-2-yl]-2,3-dihydro-1H-inden-5-ol (PubChem CID 66519356) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 4-methoxy-7-[(2R)-pyrrolidin-2-yl]-2,3-dihydro-1H-inden-5-ol.

Molecular Properties

Compound Name4-methoxy-7-[(2R)-pyrrolidin-2-yl]-2,3-dihydro-1H-inden-5-ol
PubChem CID66519356
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name4-methoxy-7-[(2R)-pyrrolidin-2-yl]-2,3-dihydro-1H-inden-5-ol
SMILESCOc1c(O)cc([C@H]2CCCN2)c2c1CCC2
InChIInChI=1S/C14H19NO2/c1-17-14-10-5-2-4-9(10)11(8-13(14)16)12-6-3-7-15-12/h8,12,15-16H,2-7H2,1H3/t12-/m1/s1
InChIKeyWDZZMJIKARGPNO-GFCCVEGCSA-N
XLogP2.31
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

7-methoxy-6-[(2S)-pyrrolidin-2-yl]-2,3-dihydro-1H-indene-4-carbonitrile
CID 66519501
2-(2,5-dimethoxy-3-methylphenyl)pyrrolidine
CID 84686830
2-methoxy-5,6-dimethyl-3-piperidin-2-ylphenol
CID 117343133
2-(5-bromo-2-methoxy-3-methylphenyl)pyrrolidine
CID 117428409
2-(4-methoxy-2,3,5-trimethylphenyl)pyrrolidine
CID 82286064
2-(4-chloro-3-methoxy-5,6,7,8-tetrahydronaphthalen-2-yl)pyrrolidine
CID 117418762
2-methoxy-3,6-dimethyl-4-piperidin-2-ylphenol
CID 84698765
2-bromo-3,4-dimethoxy-6-pyrrolidin-2-ylphenol
CID 117486235
5-methoxy-2-[(2R)-pyrrolidin-2-yl]phenol;hydrochloride
CID 171195842
2,3-dimethoxy-6-pyrrolidin-2-ylphenol
CID 77131807
2-fluoro-3,4-dimethoxy-6-pyrrolidin-2-ylphenol
CID 117354943
(2R)-2-(4-methoxy-3,5-dimethylphenyl)pyrrolidine
CID 66518898

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-7-[(2R)-pyrrolidin-2-yl]-2,3-dihydro-1H-inden-5-ol?
The IUPAC name of 4-methoxy-7-[(2R)-pyrrolidin-2-yl]-2,3-dihydro-1H-inden-5-ol (CID 66519356) is 4-methoxy-7-[(2R)-pyrrolidin-2-yl]-2,3-dihydro-1H-inden-5-ol.
What is the SMILES notation for 4-methoxy-7-[(2R)-pyrrolidin-2-yl]-2,3-dihydro-1H-inden-5-ol?
The canonical SMILES for 4-methoxy-7-[(2R)-pyrrolidin-2-yl]-2,3-dihydro-1H-inden-5-ol is COc1c(O)cc([C@H]2CCCN2)c2c1CCC2.
What is the InChIKey of 4-methoxy-7-[(2R)-pyrrolidin-2-yl]-2,3-dihydro-1H-inden-5-ol?
The InChIKey is WDZZMJIKARGPNO-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H19NO2/c1-17-14-10-5-2-4-9(10)11(8-13(14)16)12-6-3-7-15-12/h8,12,15-16H,2-7H2,1H3/t12-/m1/s1.
What are the key properties of 4-methoxy-7-[(2R)-pyrrolidin-2-yl]-2,3-dihydro-1H-inden-5-ol?
4-methoxy-7-[(2R)-pyrrolidin-2-yl]-2,3-dihydro-1H-inden-5-ol has a molecular weight of 233.31 g/mol, XLogP of 2.31, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-7-[(2R)-pyrrolidin-2-yl]-2,3-dihydro-1H-inden-5-ol is sourced from PubChem (CID 66519356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).