1-(4-ethylpiperazin-1-yl)-2,3-dihydro-1H-inden-5-ol

C15H22N2O — CID 107684921

IUPAC1-(4-ethylpiperazin-1-yl)-2,3-dihydro-1H-inden-5-ol
SMILESCCN1CCN(C2CCc3cc(O)ccc32)CC1
InChIInChI=1S/C15H22N2O/c1-2-16-7-9-17(10-8-16)15-6-3-12-11-13(18)4-5-14(12)15/h4-5,11,15,18H,2-3,6-10H2,1H3
InChIKeyKRIBWFCQEYAYAF-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.02
Rot. Bonds2

About 1-(4-ethylpiperazin-1-yl)-2,3-dihydro-1H-inden-5-ol

1-(4-ethylpiperazin-1-yl)-2,3-dihydro-1H-inden-5-ol (PubChem CID 107684921) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 1-(4-ethylpiperazin-1-yl)-2,3-dihydro-1H-inden-5-ol.

Molecular Properties

Compound Name1-(4-ethylpiperazin-1-yl)-2,3-dihydro-1H-inden-5-ol
PubChem CID107684921
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name1-(4-ethylpiperazin-1-yl)-2,3-dihydro-1H-inden-5-ol
SMILESCCN1CCN(C2CCc3cc(O)ccc32)CC1
InChIInChI=1S/C15H22N2O/c1-2-16-7-9-17(10-8-16)15-6-3-12-11-13(18)4-5-14(12)15/h4-5,11,15,18H,2-3,6-10H2,1H3
InChIKeyKRIBWFCQEYAYAF-UHFFFAOYSA-N
XLogP2.02
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(4-ethylpiperazin-1-yl)-2,3-dihydro-1H-inden-5-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

(1S)-1-pyrrolidin-1-yl-2,3-dihydro-1H-inden-5-ol
CID 129390892
(1S)-1-piperidin-1-yl-2,3-dihydro-1H-inden-5-ol
CID 129389365
1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2,3-dihydro-1H-inden-5-ol
CID 107684985
5-(4-ethylpiperidin-1-yl)-5,6,7,8-tetrahydronaphthalen-2-ol
CID 82985819
1-(2-propylpiperidin-1-yl)-2,3-dihydro-1H-inden-5-ol
CID 107685129
1-(2,2,6,6-tetramethylmorpholin-4-yl)-2,3-dihydro-1H-inden-5-ol
CID 107685147
2-[4-[(1R)-5-bromo-2,3-dihydro-1H-inden-1-yl]piperazin-1-yl]ethanol
CID 171525185
4-(4-ethylpiperazin-1-yl)-2,2-dimethyl-3,4-dihydrochromen-7-ol
CID 82958421
1-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-2,3-dihydro-1H-inden-5-ol
CID 107684907
1-[(1-propylpiperidin-4-yl)amino]-2,3-dihydro-1H-inden-5-ol
CID 107681901
(2R)-3-[4-[(1S)-5-bromo-2,3-dihydro-1H-inden-1-yl]piperazin-1-yl]propane-1,2-diol
CID 171524934
(4aR,10bR)-4-ethyl-2,3,4a,5,6,10b-hexahydrobenzo[h][1,4]benzoxazin-8-ol
CID 13293109

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylpiperazin-1-yl)-2,3-dihydro-1H-inden-5-ol?
The IUPAC name of 1-(4-ethylpiperazin-1-yl)-2,3-dihydro-1H-inden-5-ol (CID 107684921) is 1-(4-ethylpiperazin-1-yl)-2,3-dihydro-1H-inden-5-ol.
What is the SMILES notation for 1-(4-ethylpiperazin-1-yl)-2,3-dihydro-1H-inden-5-ol?
The canonical SMILES for 1-(4-ethylpiperazin-1-yl)-2,3-dihydro-1H-inden-5-ol is CCN1CCN(C2CCc3cc(O)ccc32)CC1.
What is the InChIKey of 1-(4-ethylpiperazin-1-yl)-2,3-dihydro-1H-inden-5-ol?
The InChIKey is KRIBWFCQEYAYAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-2-16-7-9-17(10-8-16)15-6-3-12-11-13(18)4-5-14(12)15/h4-5,11,15,18H,2-3,6-10H2,1H3.
What are the key properties of 1-(4-ethylpiperazin-1-yl)-2,3-dihydro-1H-inden-5-ol?
1-(4-ethylpiperazin-1-yl)-2,3-dihydro-1H-inden-5-ol has a molecular weight of 246.35 g/mol, XLogP of 2.02, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylpiperazin-1-yl)-2,3-dihydro-1H-inden-5-ol is sourced from PubChem (CID 107684921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).