4-(2,3-dihydroindol-1-yl)-2-(ethylamino)-2-methylbutan-1-ol

C15H24N2O — CID 64796909

IUPAC4-(2,3-dihydroindol-1-yl)-2-(ethylamino)-2-methylbutan-1-ol
SMILESCCNC(C)(CO)CCN1CCc2ccccc21
InChIInChI=1S/C15H24N2O/c1-3-16-15(2,12-18)9-11-17-10-8-13-6-4-5-7-14(13)17/h4-7,16,18H,3,8-12H2,1-2H3
InChIKeyWXBFPIMHLWSKHD-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.80
Rot. Bonds6

About 4-(2,3-dihydroindol-1-yl)-2-(ethylamino)-2-methylbutan-1-ol

4-(2,3-dihydroindol-1-yl)-2-(ethylamino)-2-methylbutan-1-ol (PubChem CID 64796909) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 4-(2,3-dihydroindol-1-yl)-2-(ethylamino)-2-methylbutan-1-ol.

Molecular Properties

Compound Name4-(2,3-dihydroindol-1-yl)-2-(ethylamino)-2-methylbutan-1-ol
PubChem CID64796909
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name4-(2,3-dihydroindol-1-yl)-2-(ethylamino)-2-methylbutan-1-ol
SMILESCCNC(C)(CO)CCN1CCc2ccccc21
InChIInChI=1S/C15H24N2O/c1-3-16-15(2,12-18)9-11-17-10-8-13-6-4-5-7-14(13)17/h4-7,16,18H,3,8-12H2,1-2H3
InChIKeyWXBFPIMHLWSKHD-UHFFFAOYSA-N
XLogP1.80
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(2,3-dihydroindol-1-yl)-2-(ethylamino)-2-methylbutan-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

4-(2,3-dihydroindol-1-yl)-2-methyl-2-(propylamino)butan-1-ol
CID 64796687
2-(ethylamino)-2-methyl-4-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)butan-1-ol
CID 64791594
6-(2,3-dihydroindol-1-yl)-2-methyl-2-(propan-2-ylamino)hexan-1-ol
CID 64797124
1-(2,3-dihydroindol-1-yl)-N-ethyl-2-methylpropan-2-amine
CID 62834088
2-(ethylamino)-2-methyl-5-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)pentan-1-ol
CID 64795808
2-(2,3-dihydroindol-1-yl)ethanol;hydrochloride
CID 169005265
2-[[3-(2,3-dihydroindol-1-yl)propylamino]methyl]-2-methylbutan-1-ol
CID 81412714
4-(3,4-dihydro-2H-quinolin-1-yl)-2-methylbutan-2-ol
CID 79316472
4-(1,3-dihydroisoindol-2-yl)-2-methyl-2-(propylamino)butan-1-ol
CID 64786243
1-butyl-2,3-dihydroindole
CID 4167209
2-amino-5-(3,4-dihydro-2H-quinolin-1-yl)-2-methylpentan-1-ol
CID 64797597
1-(2,2-dimethylbutyl)-2,3-dihydroindole
CID 167187652

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dihydroindol-1-yl)-2-(ethylamino)-2-methylbutan-1-ol?
The IUPAC name of 4-(2,3-dihydroindol-1-yl)-2-(ethylamino)-2-methylbutan-1-ol (CID 64796909) is 4-(2,3-dihydroindol-1-yl)-2-(ethylamino)-2-methylbutan-1-ol.
What is the SMILES notation for 4-(2,3-dihydroindol-1-yl)-2-(ethylamino)-2-methylbutan-1-ol?
The canonical SMILES for 4-(2,3-dihydroindol-1-yl)-2-(ethylamino)-2-methylbutan-1-ol is CCNC(C)(CO)CCN1CCc2ccccc21.
What is the InChIKey of 4-(2,3-dihydroindol-1-yl)-2-(ethylamino)-2-methylbutan-1-ol?
The InChIKey is WXBFPIMHLWSKHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-3-16-15(2,12-18)9-11-17-10-8-13-6-4-5-7-14(13)17/h4-7,16,18H,3,8-12H2,1-2H3.
What are the key properties of 4-(2,3-dihydroindol-1-yl)-2-(ethylamino)-2-methylbutan-1-ol?
4-(2,3-dihydroindol-1-yl)-2-(ethylamino)-2-methylbutan-1-ol has a molecular weight of 248.37 g/mol, XLogP of 1.80, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dihydroindol-1-yl)-2-(ethylamino)-2-methylbutan-1-ol is sourced from PubChem (CID 64796909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).