6-methoxy-1-pyrrolidin-2-yl-2,3-dihydroinden-1-ol

C14H19NO2 — CID 79375065

IUPAC6-methoxy-1-pyrrolidin-2-yl-2,3-dihydroinden-1-ol
SMILESCOc1ccc2c(c1)C(O)(C1CCCN1)CC2
InChIInChI=1S/C14H19NO2/c1-17-11-5-4-10-6-7-14(16,12(10)9-11)13-3-2-8-15-13/h4-5,9,13,15-16H,2-3,6-8H2,1H3
InChIKeyBFHBSQVJTIWQMJ-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.58
Rot. Bonds2

About 6-methoxy-1-pyrrolidin-2-yl-2,3-dihydroinden-1-ol

6-methoxy-1-pyrrolidin-2-yl-2,3-dihydroinden-1-ol (PubChem CID 79375065) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 6-methoxy-1-pyrrolidin-2-yl-2,3-dihydroinden-1-ol.

Molecular Properties

Compound Name6-methoxy-1-pyrrolidin-2-yl-2,3-dihydroinden-1-ol
PubChem CID79375065
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name6-methoxy-1-pyrrolidin-2-yl-2,3-dihydroinden-1-ol
SMILESCOc1ccc2c(c1)C(O)(C1CCCN1)CC2
InChIInChI=1S/C14H19NO2/c1-17-11-5-4-10-6-7-14(16,12(10)9-11)13-3-2-8-15-13/h4-5,9,13,15-16H,2-3,6-8H2,1H3
InChIKeyBFHBSQVJTIWQMJ-UHFFFAOYSA-N
XLogP1.58
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 ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopentyl-6-methoxy-2,3-dihydroinden-1-ol
CID 79374780
1-(1,3-dithian-2-yl)-6-methoxy-2,3-dihydroinden-1-ol
CID 14843789
(3aS,9bR)-8-methoxy-9b-methyl-1,2,3,3a,4,5-hexahydrobenzo[e]indole
CID 132566320
1-(4-ethylcyclohexyl)-6-methoxy-2,3-dihydroinden-1-ol
CID 79374140
7-methoxy-1-(1-methylpiperidin-4-yl)-3,4-dihydro-2H-naphthalen-1-ol
CID 19784338
2-[1-(4-methoxyphenyl)cyclopropyl]pyrrolidine
CID 83910096
(1R,9S,10S)-4-methoxy-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-10-ol
CID 15971096
(1S,9R)-4-methoxy-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-10-ol
CID 131964401
6-methoxy-1-(methoxymethyl)-2,3-dihydroinden-1-ol
CID 79568236
1-ethynyl-6-methoxy-2,3-dihydroinden-1-ol
CID 79374777
1-hydroxy-7-methoxy-3,4-dihydro-2H-naphthalene-1-carbonitrile
CID 79248307
2-(1-hydroxy-7-methoxy-3,4-dihydro-2H-naphthalen-1-yl)acetonitrile
CID 11769906

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-1-pyrrolidin-2-yl-2,3-dihydroinden-1-ol?
The IUPAC name of 6-methoxy-1-pyrrolidin-2-yl-2,3-dihydroinden-1-ol (CID 79375065) is 6-methoxy-1-pyrrolidin-2-yl-2,3-dihydroinden-1-ol.
What is the SMILES notation for 6-methoxy-1-pyrrolidin-2-yl-2,3-dihydroinden-1-ol?
The canonical SMILES for 6-methoxy-1-pyrrolidin-2-yl-2,3-dihydroinden-1-ol is COc1ccc2c(c1)C(O)(C1CCCN1)CC2.
What is the InChIKey of 6-methoxy-1-pyrrolidin-2-yl-2,3-dihydroinden-1-ol?
The InChIKey is BFHBSQVJTIWQMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-17-11-5-4-10-6-7-14(16,12(10)9-11)13-3-2-8-15-13/h4-5,9,13,15-16H,2-3,6-8H2,1H3.
What are the key properties of 6-methoxy-1-pyrrolidin-2-yl-2,3-dihydroinden-1-ol?
6-methoxy-1-pyrrolidin-2-yl-2,3-dihydroinden-1-ol has a molecular weight of 233.31 g/mol, XLogP of 1.58, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-1-pyrrolidin-2-yl-2,3-dihydroinden-1-ol is sourced from PubChem (CID 79375065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).