2-[4-amino-7-[2-(dimethylamino)ethoxy]-2,3-dimethylindol-1-yl]ethanol;2-[4-amino-7-(2-hydroxyethoxy)-2,3-dimethylindol-1-yl]ethanol;2-(4-amino-1,2,3-trimethylindol-7-yl)oxyethanol;7-[2-(dimethylamino)ethoxy]-2,3-dimethyl-1H-indol-4-amine;7-[2-(dimethylamino)ethoxy]-1,2,3-trimethylindol-4-amine

C72H107N13O9 — CID 157237871

IUPAC2-[4-amino-7-[2-(dimethylamino)ethoxy]-2,3-dimethylindol-1-yl]ethanol;2-[4-amino-7-(2-hydroxyethoxy)-2,3-dimethylindol-1-yl]ethanol;2-(4-amino-1,2,3-trimethylindol-7-yl)oxyethanol;7-[2-(dimethylamino)ethoxy]-2,3-dimethyl-1H-indol-4-amine;7-[2-(dimethylamino)ethoxy]-1,2,3-trimethylindol-4-amine
SMILESCc1[nH]c2c(OCCN(C)C)ccc(N)c2c1C.Cc1c(C)n(C)c2c(OCCN(C)C)ccc(N)c12.Cc1c(C)n(C)c2c(OCCO)ccc(N)c12.Cc1c(C)n(CCO)c2c(OCCN(C)C)ccc(N)c12.Cc1c(C)n(CCO)c2c(OCCO)ccc(N)c12
InChIInChI=1S/C16H25N3O2.C15H23N3O.C14H21N3O.C14H20N2O3.C13H18N2O2/c1-11-12(2)19(7-9-20)16-14(21-10-8-18(3)4)6-5-13(17)15(11)16;1-10-11(2)18(5)15-13(19-9-8-17(3)4)7-6-12(16)14(10)15;1-9-10(2)16-14-12(18-8-7-17(3)4)6-5-11(15)13(9)14;1-9-10(2)16(5-6-17)14-12(19-8-7-18)4-3-11(15)13(9)14;1-8-9(2)15(3)13-11(17-7-6-16)5-4-10(14)12(8)13/h5-6,20H,7-10,17H2,1-4H3;6-7H,8-9,16H2,1-5H3;5-6,16H,7-8,15H2,1-4H3;3-4,17-18H,5-8,15H2,1-2H3;4-5,16H,6-7,14H2,1-3H3
InChIKeyAUVTWWXYCUJQEI-UHFFFAOYSA-N
MW1298.73 g/mol
LogP9.35
Rot. Bonds22

About 2-[4-amino-7-[2-(dimethylamino)ethoxy]-2,3-dimethylindol-1-yl]ethanol;2-[4-amino-7-(2-hydroxyethoxy)-2,3-dimethylindol-1-yl]ethanol;2-(4-amino-1,2,3-trimethylindol-7-yl)oxyethanol;7-[2-(dimethylamino)ethoxy]-2,3-dimethyl-1H-indol-4-amine;7-[2-(dimethylamino)ethoxy]-1,2,3-trimethylindol-4-amine

2-[4-amino-7-[2-(dimethylamino)ethoxy]-2,3-dimethylindol-1-yl]ethanol;2-[4-amino-7-(2-hydroxyethoxy)-2,3-dimethylindol-1-yl]ethanol;2-(4-amino-1,2,3-trimethylindol-7-yl)oxyethanol;7-[2-(dimethylamino)ethoxy]-2,3-dimethyl-1H-indol-4-amine;7-[2-(dimethylamino)ethoxy]-1,2,3-trimethylindol-4-amine (PubChem CID 157237871) has the molecular formula C72H107N13O9 and a molecular weight of 1298.73 g/mol. Its IUPAC name is 2-[4-amino-7-[2-(dimethylamino)ethoxy]-2,3-dimethylindol-1-yl]ethanol;2-[4-amino-7-(2-hydroxyethoxy)-2,3-dimethylindol-1-yl]ethanol;2-(4-amino-1,2,3-trimethylindol-7-yl)oxyethanol;7-[2-(dimethylamino)ethoxy]-2,3-dimethyl-1H-indol-4-amine;7-[2-(dimethylamino)ethoxy]-1,2,3-trimethylindol-4-amine.

Molecular Properties

Compound Name2-[4-amino-7-[2-(dimethylamino)ethoxy]-2,3-dimethylindol-1-yl]ethanol;2-[4-amino-7-(2-hydroxyethoxy)-2,3-dimethylindol-1-yl]ethanol;2-(4-amino-1,2,3-trimethylindol-7-yl)oxyethanol;7-[2-(dimethylamino)ethoxy]-2,3-dimethyl-1H-indol-4-amine;7-[2-(dimethylamino)ethoxy]-1,2,3-trimethylindol-4-amine
PubChem CID157237871
Molecular FormulaC72H107N13O9
Molecular Weight1298.73 g/mol
Exact Mass1297.83
IUPAC Name2-[4-amino-7-[2-(dimethylamino)ethoxy]-2,3-dimethylindol-1-yl]ethanol;2-[4-amino-7-(2-hydroxyethoxy)-2,3-dimethylindol-1-yl]ethanol;2-(4-amino-1,2,3-trimethylindol-7-yl)oxyethanol;7-[2-(dimethylamino)ethoxy]-2,3-dimethyl-1H-indol-4-amine;7-[2-(dimethylamino)ethoxy]-1,2,3-trimethylindol-4-amine
SMILESCc1[nH]c2c(OCCN(C)C)ccc(N)c2c1C.Cc1c(C)n(C)c2c(OCCN(C)C)ccc(N)c12.Cc1c(C)n(C)c2c(OCCO)ccc(N)c12.Cc1c(C)n(CCO)c2c(OCCN(C)C)ccc(N)c12.Cc1c(C)n(CCO)c2c(OCCO)ccc(N)c12
InChIInChI=1S/C16H25N3O2.C15H23N3O.C14H21N3O.C14H20N2O3.C13H18N2O2/c1-11-12(2)19(7-9-20)16-14(21-10-8-18(3)4)6-5-13(17)15(11)16;1-10-11(2)18(5)15-13(19-9-8-17(3)4)7-6-12(16)14(10)15;1-9-10(2)16-14-12(18-8-7-17(3)4)6-5-11(15)13(9)14;1-9-10(2)16(5-6-17)14-12(19-8-7-18)4-3-11(15)13(9)14;1-8-9(2)15(3)13-11(17-7-6-16)5-4-10(14)12(8)13/h5-6,20H,7-10,17H2,1-4H3;6-7H,8-9,16H2,1-5H3;5-6,16H,7-8,15H2,1-4H3;3-4,17-18H,5-8,15H2,1-2H3;4-5,16H,6-7,14H2,1-3H3
InChIKeyAUVTWWXYCUJQEI-UHFFFAOYSA-N
XLogP9.35
TPSA302.40 Ų
H-Bond Donors10
H-Bond Acceptors21
Rotatable Bonds22
Heavy Atoms94
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001298.73
LogP ≤ 59.35
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1021

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 2-[4-amino-7-[2-(dimethylamino)ethoxy]-2,3-dimethylindol-1-yl]ethanol;2-[4-amino-7-(2-hydroxyethoxy)-2,3-dimethylindol-1-yl]ethanol;2-(4-amino-1,2,3-trimethylindol-7-yl)oxyethanol;7-[2-(dimethylamino)ethoxy]-2,3-dimethyl-1H-indol-4-amine;7-[2-(dimethylamino)ethoxy]-1,2,3-trimethylindol-4-amine 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-[3-[10,15,20-Tris[3-(2-hydroxyethoxy)phenyl]-21,23-dihydroporphyrin-5-yl]phenoxy]ethanol
CID 135923710
2-[3-[11,20,29-Tris[3-(2-hydroxyethoxy)phenyl]-37,38,39,40-tetrazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1(37),2,4,6,8,10,12(39),13,15,17,19,21,23,25,27,29,31,33,35-nonadecaen-2-yl]phenoxy]ethanol
CID 177643886
1-[2-(4-Aminopiperidin-1-yl)-4-(3-aminopyrrolidin-1-yl)-2,4,6-tris[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]hexyl]azetidin-3-ol
CID 88962041
2-(2,10-difluoro-6-methoxy-7H-indolo[2,3-b]carbazol-5-yl)-N,N-dimethylethanamine;6-ethyl-5,7-dihydroindolo[2,3-b]carbazole;6-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazole
CID 162087738
1-methoxy-9-[(1-methoxy-9H-carbazol-3-yl)methyl]-3-[(1-methoxy-3-methylcarbazol-9-yl)methyl]carbazole
CID 102015823
2-[2-[2,3,21-tris[2-(2-hydroxyethoxy)phenyl]-23H-porphyrin-5-yl]phenoxy]ethanol
CID 67834068
7-methoxy-2,3-dimethyl-1H-indol-4-amine;7-methoxy-1,2,3-trimethylindol-4-amine
CID 67973389
2-[4-amino-7-(2-hydroxyethoxy)-2,3-dimethylindol-1-yl]ethanol;7-[2-(dimethylamino)ethoxy]-2,3-dimethyl-1H-indol-4-amine
CID 67973446
7-ethoxy-3-ethyl-1,2-dimethylindol-4-amine;7-ethoxy-3-ethyl-2-methyl-1H-indol-4-amine
CID 67973558
2-(4-amino-2,3-dimethyl-1H-indol-7-yl)-2-(4-amino-1,2,3-trimethylindol-7-yl)oxy-1-(2-hydroxyethoxy)ethanol
CID 67973810
2-[4-(Ethylamino)-7-(2-hydroxyethoxy)-2,3-dimethylindol-1-yl]ethanol
CID 67989227
2-(2,10-difluoro-6-methyl-7H-indolo[2,3-b]carbazol-5-yl)-N,N-dimethylethanamine;2-[5-[2-(dimethylamino)ethyl]-2,10-difluoro-6-methoxyindolo[2,3-b]carbazol-7-yl]-N,N-dimethylethanamine
CID 68385305

Frequently Asked Questions

What is the IUPAC name of 2-[4-amino-7-[2-(dimethylamino)ethoxy]-2,3-dimethylindol-1-yl]ethanol;2-[4-amino-7-(2-hydroxyethoxy)-2,3-dimethylindol-1-yl]ethanol;2-(4-amino-1,2,3-trimethylindol-7-yl)oxyethanol;7-[2-(dimethylamino)ethoxy]-2,3-dimethyl-1H-indol-4-amine;7-[2-(dimethylamino)ethoxy]-1,2,3-trimethylindol-4-amine?
The IUPAC name of 2-[4-amino-7-[2-(dimethylamino)ethoxy]-2,3-dimethylindol-1-yl]ethanol;2-[4-amino-7-(2-hydroxyethoxy)-2,3-dimethylindol-1-yl]ethanol;2-(4-amino-1,2,3-trimethylindol-7-yl)oxyethanol;7-[2-(dimethylamino)ethoxy]-2,3-dimethyl-1H-indol-4-amine;7-[2-(dimethylamino)ethoxy]-1,2,3-trimethylindol-4-amine (CID 157237871) is 2-[4-amino-7-[2-(dimethylamino)ethoxy]-2,3-dimethylindol-1-yl]ethanol;2-[4-amino-7-(2-hydroxyethoxy)-2,3-dimethylindol-1-yl]ethanol;2-(4-amino-1,2,3-trimethylindol-7-yl)oxyethanol;7-[2-(dimethylamino)ethoxy]-2,3-dimethyl-1H-indol-4-amine;7-[2-(dimethylamino)ethoxy]-1,2,3-trimethylindol-4-amine.
What is the SMILES notation for 2-[4-amino-7-[2-(dimethylamino)ethoxy]-2,3-dimethylindol-1-yl]ethanol;2-[4-amino-7-(2-hydroxyethoxy)-2,3-dimethylindol-1-yl]ethanol;2-(4-amino-1,2,3-trimethylindol-7-yl)oxyethanol;7-[2-(dimethylamino)ethoxy]-2,3-dimethyl-1H-indol-4-amine;7-[2-(dimethylamino)ethoxy]-1,2,3-trimethylindol-4-amine?
The canonical SMILES for 2-[4-amino-7-[2-(dimethylamino)ethoxy]-2,3-dimethylindol-1-yl]ethanol;2-[4-amino-7-(2-hydroxyethoxy)-2,3-dimethylindol-1-yl]ethanol;2-(4-amino-1,2,3-trimethylindol-7-yl)oxyethanol;7-[2-(dimethylamino)ethoxy]-2,3-dimethyl-1H-indol-4-amine;7-[2-(dimethylamino)ethoxy]-1,2,3-trimethylindol-4-amine is Cc1[nH]c2c(OCCN(C)C)ccc(N)c2c1C.Cc1c(C)n(C)c2c(OCCN(C)C)ccc(N)c12.Cc1c(C)n(C)c2c(OCCO)ccc(N)c12.Cc1c(C)n(CCO)c2c(OCCN(C)C)ccc(N)c12.Cc1c(C)n(CCO)c2c(OCCO)ccc(N)c12.
What is the InChIKey of 2-[4-amino-7-[2-(dimethylamino)ethoxy]-2,3-dimethylindol-1-yl]ethanol;2-[4-amino-7-(2-hydroxyethoxy)-2,3-dimethylindol-1-yl]ethanol;2-(4-amino-1,2,3-trimethylindol-7-yl)oxyethanol;7-[2-(dimethylamino)ethoxy]-2,3-dimethyl-1H-indol-4-amine;7-[2-(dimethylamino)ethoxy]-1,2,3-trimethylindol-4-amine?
The InChIKey is AUVTWWXYCUJQEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2.C15H23N3O.C14H21N3O.C14H20N2O3.C13H18N2O2/c1-11-12(2)19(7-9-20)16-14(21-10-8-18(3)4)6-5-13(17)15(11)16;1-10-11(2)18(5)15-13(19-9-8-17(3)4)7-6-12(16)14(10)15;1-9-10(2)16-14-12(18-8-7-17(3)4)6-5-11(15)13(9)14;1-9-10(2)16(5-6-17)14-12(19-8-7-18)4-3-11(15)13(9)14;1-8-9(2)15(3)13-11(17-7-6-16)5-4-10(14)12(8)13/h5-6,20H,7-10,17H2,1-4H3;6-7H,8-9,16H2,1-5H3;5-6,16H,7-8,15H2,1-4H3;3-4,17-18H,5-8,15H2,1-2H3;4-5,16H,6-7,14H2,1-3H3.
What are the key properties of 2-[4-amino-7-[2-(dimethylamino)ethoxy]-2,3-dimethylindol-1-yl]ethanol;2-[4-amino-7-(2-hydroxyethoxy)-2,3-dimethylindol-1-yl]ethanol;2-(4-amino-1,2,3-trimethylindol-7-yl)oxyethanol;7-[2-(dimethylamino)ethoxy]-2,3-dimethyl-1H-indol-4-amine;7-[2-(dimethylamino)ethoxy]-1,2,3-trimethylindol-4-amine?
2-[4-amino-7-[2-(dimethylamino)ethoxy]-2,3-dimethylindol-1-yl]ethanol;2-[4-amino-7-(2-hydroxyethoxy)-2,3-dimethylindol-1-yl]ethanol;2-(4-amino-1,2,3-trimethylindol-7-yl)oxyethanol;7-[2-(dimethylamino)ethoxy]-2,3-dimethyl-1H-indol-4-amine;7-[2-(dimethylamino)ethoxy]-1,2,3-trimethylindol-4-amine has a molecular weight of 1298.73 g/mol, XLogP of 9.35, 22 rotatable bonds, 10 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-amino-7-[2-(dimethylamino)ethoxy]-2,3-dimethylindol-1-yl]ethanol;2-[4-amino-7-(2-hydroxyethoxy)-2,3-dimethylindol-1-yl]ethanol;2-(4-amino-1,2,3-trimethylindol-7-yl)oxyethanol;7-[2-(dimethylamino)ethoxy]-2,3-dimethyl-1H-indol-4-amine;7-[2-(dimethylamino)ethoxy]-1,2,3-trimethylindol-4-amine is sourced from PubChem (CID 157237871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).