1-(1-hydroxy-2-methylpropan-2-yl)-5-[2-(methylamino)ethyl]-3H-indol-2-one

C15H22N2O2 — CID 115133664

IUPAC1-(1-hydroxy-2-methylpropan-2-yl)-5-[2-(methylamino)ethyl]-3H-indol-2-one
SMILESCNCCc1ccc2c(c1)CC(=O)N2C(C)(C)CO
InChIInChI=1S/C15H22N2O2/c1-15(2,10-18)17-13-5-4-11(6-7-16-3)8-12(13)9-14(17)19/h4-5,8,16,18H,6-7,9-10H2,1-3H3
InChIKeyDMMXHBLYYBCIPN-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.11
Rot. Bonds5

About 1-(1-hydroxy-2-methylpropan-2-yl)-5-[2-(methylamino)ethyl]-3H-indol-2-one

1-(1-hydroxy-2-methylpropan-2-yl)-5-[2-(methylamino)ethyl]-3H-indol-2-one (PubChem CID 115133664) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 1-(1-hydroxy-2-methylpropan-2-yl)-5-[2-(methylamino)ethyl]-3H-indol-2-one.

Molecular Properties

Compound Name1-(1-hydroxy-2-methylpropan-2-yl)-5-[2-(methylamino)ethyl]-3H-indol-2-one
PubChem CID115133664
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name1-(1-hydroxy-2-methylpropan-2-yl)-5-[2-(methylamino)ethyl]-3H-indol-2-one
SMILESCNCCc1ccc2c(c1)CC(=O)N2C(C)(C)CO
InChIInChI=1S/C15H22N2O2/c1-15(2,10-18)17-13-5-4-11(6-7-16-3)8-12(13)9-14(17)19/h4-5,8,16,18H,6-7,9-10H2,1-3H3
InChIKeyDMMXHBLYYBCIPN-UHFFFAOYSA-N
XLogP1.11
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(1-hydroxy-2-methylpropan-2-yl)-5-[2-(methylamino)ethyl]-3H-indol-2-one 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

1-(2-amino-2-methylpropyl)-5-[2-(methylamino)ethyl]-3H-indol-2-one
CID 115136265
3-[5-[2-(methylamino)ethyl]-2-oxo-3H-indol-1-yl]propanenitrile
CID 115231217
5-[2-(methylamino)ethyl]-1-(3-sulfanylpropyl)-3H-indol-2-one
CID 115225243
1-[2-(ethylamino)ethyl]-5-[2-(methylamino)ethyl]-3H-indol-2-one
CID 115206096
N-[2-(1-methyl-2-oxo-3H-indol-5-yl)ethyl]carbamoyl bromide
CID 115193913
N-[2-(1-methyl-2-oxo-3H-indol-5-yl)ethyl]carbamoyl chloride
CID 115194905
1-methyl-5-[2-(propan-2-ylamino)ethyl]-3H-indol-2-one
CID 82475334
2-[2-(1-methyl-2-oxo-3H-indol-5-yl)ethylamino]-2-oxoacetic acid
CID 115141454
1-methyl-5-[2-(2-sulfanylethylamino)ethyl]-3H-indol-2-one
CID 115224218
2-[2-(1-methyl-2-oxo-3H-indol-5-yl)ethylamino]acetamide
CID 115260099
methyl 6-[2-(methylamino)ethyl]-2-oxo-3,4-dihydroquinoline-1-carboxylate
CID 115190786
N-[2-(1-methyl-2-oxo-3H-indol-5-yl)ethyl]-3-(4-methylphenyl)propanamide
CID 110788570

Frequently Asked Questions

What is the IUPAC name of 1-(1-hydroxy-2-methylpropan-2-yl)-5-[2-(methylamino)ethyl]-3H-indol-2-one?
The IUPAC name of 1-(1-hydroxy-2-methylpropan-2-yl)-5-[2-(methylamino)ethyl]-3H-indol-2-one (CID 115133664) is 1-(1-hydroxy-2-methylpropan-2-yl)-5-[2-(methylamino)ethyl]-3H-indol-2-one.
What is the SMILES notation for 1-(1-hydroxy-2-methylpropan-2-yl)-5-[2-(methylamino)ethyl]-3H-indol-2-one?
The canonical SMILES for 1-(1-hydroxy-2-methylpropan-2-yl)-5-[2-(methylamino)ethyl]-3H-indol-2-one is CNCCc1ccc2c(c1)CC(=O)N2C(C)(C)CO.
What is the InChIKey of 1-(1-hydroxy-2-methylpropan-2-yl)-5-[2-(methylamino)ethyl]-3H-indol-2-one?
The InChIKey is DMMXHBLYYBCIPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-15(2,10-18)17-13-5-4-11(6-7-16-3)8-12(13)9-14(17)19/h4-5,8,16,18H,6-7,9-10H2,1-3H3.
What are the key properties of 1-(1-hydroxy-2-methylpropan-2-yl)-5-[2-(methylamino)ethyl]-3H-indol-2-one?
1-(1-hydroxy-2-methylpropan-2-yl)-5-[2-(methylamino)ethyl]-3H-indol-2-one has a molecular weight of 262.35 g/mol, XLogP of 1.11, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-hydroxy-2-methylpropan-2-yl)-5-[2-(methylamino)ethyl]-3H-indol-2-one is sourced from PubChem (CID 115133664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).