1-(2,3-dihydro-1H-inden-1-yl)propan-1-ol

C12H16O — CID 18690782

IUPAC1-(2,3-dihydro-1H-inden-1-yl)propan-1-ol
SMILESCCC(O)C1CCc2ccccc21
InChIInChI=1S/C12H16O/c1-2-12(13)11-8-7-9-5-3-4-6-10(9)11/h3-6,11-13H,2,7-8H2,1H3
InChIKeySGCMXDWZTLDLQQ-UHFFFAOYSA-N
MW176.26 g/mol
LogP2.49
Rot. Bonds2

About 1-(2,3-dihydro-1H-inden-1-yl)propan-1-ol

1-(2,3-dihydro-1H-inden-1-yl)propan-1-ol (PubChem CID 18690782) has the molecular formula C12H16O and a molecular weight of 176.26 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-1-yl)propan-1-ol.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-1-yl)propan-1-ol
PubChem CID18690782
Molecular FormulaC12H16O
Molecular Weight176.26 g/mol
Exact Mass176.12
IUPAC Name1-(2,3-dihydro-1H-inden-1-yl)propan-1-ol
SMILESCCC(O)C1CCc2ccccc21
InChIInChI=1S/C12H16O/c1-2-12(13)11-8-7-9-5-3-4-6-10(9)11/h3-6,11-13H,2,7-8H2,1H3
InChIKeySGCMXDWZTLDLQQ-UHFFFAOYSA-N
XLogP2.49
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,3-dihydro-1H-inden-1-yl)-3-ethylpentan-1-ol
CID 82920522
3-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-ol
CID 82920616
1-(2,3-dihydro-1H-inden-1-yl)-4-methylpent-4-en-1-ol
CID 114473913
1-(2,3-dihydro-1H-inden-1-yl)pent-4-yn-1-ol
CID 65409805
(1R)-1-propan-2-yl-2,3-dihydro-1H-indene
CID 59961726
1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)propan-1-ol
CID 79368775
1-(2,3-dihydro-1H-inden-1-yl)ethanamine
CID 23332534
1-(2,3-dihydro-1H-inden-1-yl)oct-7-en-1-ol
CID 107008599
2,3-dihydro-1H-inden-1-yl-(2-methylphenyl)methanol
CID 65410784
2-cyclopropyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanol
CID 64906726
[1-(2,3-dihydro-1H-inden-1-yl)-2-methylbutyl]hydrazine
CID 105234483
2-(2,4-difluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethanol
CID 65410003

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-1-yl)propan-1-ol?
The IUPAC name of 1-(2,3-dihydro-1H-inden-1-yl)propan-1-ol (CID 18690782) is 1-(2,3-dihydro-1H-inden-1-yl)propan-1-ol.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-1-yl)propan-1-ol?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-1-yl)propan-1-ol is CCC(O)C1CCc2ccccc21.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-1-yl)propan-1-ol?
The InChIKey is SGCMXDWZTLDLQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O/c1-2-12(13)11-8-7-9-5-3-4-6-10(9)11/h3-6,11-13H,2,7-8H2,1H3.
What are the key properties of 1-(2,3-dihydro-1H-inden-1-yl)propan-1-ol?
1-(2,3-dihydro-1H-inden-1-yl)propan-1-ol has a molecular weight of 176.26 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-inden-1-yl)propan-1-ol is sourced from PubChem (CID 18690782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).