2-(2,3-dihydro-1H-inden-5-ylmethyl)-2,3-dimethylbutan-1-ol

C16H24O — CID 83150043

IUPAC2-(2,3-dihydro-1H-inden-5-ylmethyl)-2,3-dimethylbutan-1-ol
SMILESCC(C)C(C)(CO)Cc1ccc2c(c1)CCC2
InChIInChI=1S/C16H24O/c1-12(2)16(3,11-17)10-13-7-8-14-5-4-6-15(14)9-13/h7-9,12,17H,4-6,10-11H2,1-3H3
InChIKeyNSLPUMMCAAQOKK-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.37
Rot. Bonds4

About 2-(2,3-dihydro-1H-inden-5-ylmethyl)-2,3-dimethylbutan-1-ol

2-(2,3-dihydro-1H-inden-5-ylmethyl)-2,3-dimethylbutan-1-ol (PubChem CID 83150043) has the molecular formula C16H24O and a molecular weight of 232.37 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-5-ylmethyl)-2,3-dimethylbutan-1-ol.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-5-ylmethyl)-2,3-dimethylbutan-1-ol
PubChem CID83150043
Molecular FormulaC16H24O
Molecular Weight232.37 g/mol
Exact Mass232.18
IUPAC Name2-(2,3-dihydro-1H-inden-5-ylmethyl)-2,3-dimethylbutan-1-ol
SMILESCC(C)C(C)(CO)Cc1ccc2c(c1)CCC2
InChIInChI=1S/C16H24O/c1-12(2)16(3,11-17)10-13-7-8-14-5-4-6-15(14)9-13/h7-9,12,17H,4-6,10-11H2,1-3H3
InChIKeyNSLPUMMCAAQOKK-UHFFFAOYSA-N
XLogP3.37
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(2,3-dihydro-1H-inden-5-ylmethyl)-2,3-dimethylbutan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2,3-dihydro-1H-inden-5-ylmethyl)-N-ethyl-2,3-dimethylbutan-1-amine
CID 83159396
2-(2,3-dihydro-1H-inden-5-ylmethyl)-2,3-dimethyl-N-propylbutan-1-amine
CID 83159671
1-(2,3-dihydro-1H-inden-5-yl)-2-methyl-3-(propan-2-ylamino)propan-2-ol
CID 66037730
2-amino-2-methyl-4-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pentan-1-ol
CID 64810416
2-(2,3-dihydro-1H-inden-5-ylmethyl)-2-ethylhexan-1-ol
CID 66059336
2,2-dimethyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)propanenitrile
CID 116927629
2-(2,3-dihydro-1H-inden-5-yl)-N-propan-2-ylacetamide
CID 60645732
6-(2-chloropropyl)-1,2,3,4-tetrahydronaphthalene
CID 82255501
2-[[2-(2,3-dihydro-1H-inden-5-yl)acetyl]amino]propanoic acid
CID 43239418
1-cyclobutyl-3-(2,3-dihydro-1H-inden-5-yl)-2-methylpropan-2-ol
CID 113490172
N-(2,3-dihydro-1H-inden-5-ylmethyl)propan-2-amine
CID 43163778
N-propan-2-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 60645733

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-5-ylmethyl)-2,3-dimethylbutan-1-ol?
The IUPAC name of 2-(2,3-dihydro-1H-inden-5-ylmethyl)-2,3-dimethylbutan-1-ol (CID 83150043) is 2-(2,3-dihydro-1H-inden-5-ylmethyl)-2,3-dimethylbutan-1-ol.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-5-ylmethyl)-2,3-dimethylbutan-1-ol?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-5-ylmethyl)-2,3-dimethylbutan-1-ol is CC(C)C(C)(CO)Cc1ccc2c(c1)CCC2.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-5-ylmethyl)-2,3-dimethylbutan-1-ol?
The InChIKey is NSLPUMMCAAQOKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O/c1-12(2)16(3,11-17)10-13-7-8-14-5-4-6-15(14)9-13/h7-9,12,17H,4-6,10-11H2,1-3H3.
What are the key properties of 2-(2,3-dihydro-1H-inden-5-ylmethyl)-2,3-dimethylbutan-1-ol?
2-(2,3-dihydro-1H-inden-5-ylmethyl)-2,3-dimethylbutan-1-ol has a molecular weight of 232.37 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-5-ylmethyl)-2,3-dimethylbutan-1-ol is sourced from PubChem (CID 83150043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).