2,3-dihydro-1H-inden-5-yl(1H-pyrrol-3-yl)methanol

C14H15NO — CID 63749815

IUPAC2,3-dihydro-1H-inden-5-yl(1H-pyrrol-3-yl)methanol
SMILESOC(c1cc[nH]c1)c1ccc2c(c1)CCC2
InChIInChI=1S/C14H15NO/c16-14(13-6-7-15-9-13)12-5-4-10-2-1-3-11(10)8-12/h4-9,14-16H,1-3H2
InChIKeyJEGIVDUXDLCFSJ-UHFFFAOYSA-N
MW213.28 g/mol
LogP2.59
Rot. Bonds2

About 2,3-dihydro-1H-inden-5-yl(1H-pyrrol-3-yl)methanol

2,3-dihydro-1H-inden-5-yl(1H-pyrrol-3-yl)methanol (PubChem CID 63749815) has the molecular formula C14H15NO and a molecular weight of 213.28 g/mol. Its IUPAC name is 2,3-dihydro-1H-inden-5-yl(1H-pyrrol-3-yl)methanol.

Molecular Properties

Compound Name2,3-dihydro-1H-inden-5-yl(1H-pyrrol-3-yl)methanol
PubChem CID63749815
Molecular FormulaC14H15NO
Molecular Weight213.28 g/mol
Exact Mass213.12
IUPAC Name2,3-dihydro-1H-inden-5-yl(1H-pyrrol-3-yl)methanol
SMILESOC(c1cc[nH]c1)c1ccc2c(c1)CCC2
InChIInChI=1S/C14H15NO/c16-14(13-6-7-15-9-13)12-5-4-10-2-1-3-11(10)8-12/h4-9,14-16H,1-3H2
InChIKeyJEGIVDUXDLCFSJ-UHFFFAOYSA-N
XLogP2.59
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

2,3-dihydro-1H-inden-5-yl-(4-fluorophenyl)methanol
CID 61100715
2,3-dihydro-1H-inden-5-yl-(3-iodophenyl)methanol
CID 61088523
2-(1H-pyrrol-3-yl)-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetonitrile
CID 116834286
2,3-dihydro-1H-inden-5-yl-(3,4-dimethylphenyl)methanol
CID 61101012
(3-aminophenyl)-(2,3-dihydro-1H-inden-5-yl)methanol
CID 114194374
2,3-dihydro-1H-inden-5-yl-(4-methylsulfanylphenyl)methanol
CID 79217216
(3-bromo-4-methylphenyl)-(2,3-dihydro-1H-inden-5-yl)methanol
CID 81476719
5-[2,3-dihydro-1H-inden-5-yl(hydroxy)methyl]-1,3-dihydroindol-2-one
CID 61087937
1-(2,3-dihydro-1H-inden-5-yl)-2-methylpropan-1-ol
CID 61087028
(4-chloro-3-methoxyphenyl)-(2,3-dihydro-1H-inden-5-yl)methanol
CID 115818011
2,3-dihydro-1H-inden-5-yl(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanol
CID 61086856
5-[bromo-(4-fluorophenyl)methyl]-2,3-dihydro-1H-indene
CID 63437148

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-inden-5-yl(1H-pyrrol-3-yl)methanol?
The IUPAC name of 2,3-dihydro-1H-inden-5-yl(1H-pyrrol-3-yl)methanol (CID 63749815) is 2,3-dihydro-1H-inden-5-yl(1H-pyrrol-3-yl)methanol.
What is the SMILES notation for 2,3-dihydro-1H-inden-5-yl(1H-pyrrol-3-yl)methanol?
The canonical SMILES for 2,3-dihydro-1H-inden-5-yl(1H-pyrrol-3-yl)methanol is OC(c1cc[nH]c1)c1ccc2c(c1)CCC2.
What is the InChIKey of 2,3-dihydro-1H-inden-5-yl(1H-pyrrol-3-yl)methanol?
The InChIKey is JEGIVDUXDLCFSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO/c16-14(13-6-7-15-9-13)12-5-4-10-2-1-3-11(10)8-12/h4-9,14-16H,1-3H2.
What are the key properties of 2,3-dihydro-1H-inden-5-yl(1H-pyrrol-3-yl)methanol?
2,3-dihydro-1H-inden-5-yl(1H-pyrrol-3-yl)methanol has a molecular weight of 213.28 g/mol, XLogP of 2.59, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-inden-5-yl(1H-pyrrol-3-yl)methanol is sourced from PubChem (CID 63749815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).