2-[4-amino-7-(2-hydroxyethoxy)indol-1-yl]ethanol;2-[(4-amino-1H-indol-7-yl)oxy]ethanol;3-ethyl-2-methyl-7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;3-ethyl-2-methyl-7-(2-pyrrolidin-1-ylethoxy)-1H-indol-4-amine;7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;7-(2-piperidin-1-ylethoxy)-1H-indol-4-amine

C85H118N16O11 — CID 157140266

IUPAC2-[4-amino-7-(2-hydroxyethoxy)indol-1-yl]ethanol;2-[(4-amino-1H-indol-7-yl)oxy]ethanol;3-ethyl-2-methyl-7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;3-ethyl-2-methyl-7-(2-pyrrolidin-1-ylethoxy)-1H-indol-4-amine;7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;7-(2-piperidin-1-ylethoxy)-1H-indol-4-amine
SMILESCCc1c(C)[nH]c2c(OCCN3CCCC3)ccc(N)c12.CCc1c(C)[nH]c2c(OCCN3CCOCC3)ccc(N)c12.Nc1ccc(OCCN2CCCCC2)c2[nH]ccc12.Nc1ccc(OCCN2CCOCC2)c2[nH]ccc12.Nc1ccc(OCCO)c2[nH]ccc12.Nc1ccc(OCCO)c2c1ccn2CCO
InChIInChI=1S/C17H25N3O2.C17H25N3O.C15H21N3O.C14H19N3O2.C12H16N2O3.C10H12N2O2/c1-3-13-12(2)19-17-15(5-4-14(18)16(13)17)22-11-8-20-6-9-21-10-7-20;1-3-13-12(2)19-17-15(7-6-14(18)16(13)17)21-11-10-20-8-4-5-9-20;16-13-4-5-14(15-12(13)6-7-17-15)19-11-10-18-8-2-1-3-9-18;15-12-1-2-13(14-11(12)3-4-16-14)19-10-7-17-5-8-18-9-6-17;13-10-1-2-11(17-8-7-16)12-9(10)3-4-14(12)5-6-15;11-8-1-2-9(14-6-5-13)10-7(8)3-4-12-10/h4-5,19H,3,6-11,18H2,1-2H3;6-7,19H,3-5,8-11,18H2,1-2H3;4-7,17H,1-3,8-11,16H2;1-4,16H,5-10,15H2;1-4,15-16H,5-8,13H2;1-4,12-13H,5-6,11H2
InChIKeyAKCMRRDZDSVGBR-UHFFFAOYSA-N
MW1539.98 g/mol
LogP11.21
Rot. Bonds26

About 2-[4-amino-7-(2-hydroxyethoxy)indol-1-yl]ethanol;2-[(4-amino-1H-indol-7-yl)oxy]ethanol;3-ethyl-2-methyl-7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;3-ethyl-2-methyl-7-(2-pyrrolidin-1-ylethoxy)-1H-indol-4-amine;7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;7-(2-piperidin-1-ylethoxy)-1H-indol-4-amine

2-[4-amino-7-(2-hydroxyethoxy)indol-1-yl]ethanol;2-[(4-amino-1H-indol-7-yl)oxy]ethanol;3-ethyl-2-methyl-7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;3-ethyl-2-methyl-7-(2-pyrrolidin-1-ylethoxy)-1H-indol-4-amine;7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;7-(2-piperidin-1-ylethoxy)-1H-indol-4-amine (PubChem CID 157140266) has the molecular formula C85H118N16O11 and a molecular weight of 1539.98 g/mol. Its IUPAC name is 2-[4-amino-7-(2-hydroxyethoxy)indol-1-yl]ethanol;2-[(4-amino-1H-indol-7-yl)oxy]ethanol;3-ethyl-2-methyl-7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;3-ethyl-2-methyl-7-(2-pyrrolidin-1-ylethoxy)-1H-indol-4-amine;7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;7-(2-piperidin-1-ylethoxy)-1H-indol-4-amine.

Molecular Properties

Compound Name2-[4-amino-7-(2-hydroxyethoxy)indol-1-yl]ethanol;2-[(4-amino-1H-indol-7-yl)oxy]ethanol;3-ethyl-2-methyl-7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;3-ethyl-2-methyl-7-(2-pyrrolidin-1-ylethoxy)-1H-indol-4-amine;7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;7-(2-piperidin-1-ylethoxy)-1H-indol-4-amine
PubChem CID157140266
Molecular FormulaC85H118N16O11
Molecular Weight1539.98 g/mol
Exact Mass1538.92
IUPAC Name2-[4-amino-7-(2-hydroxyethoxy)indol-1-yl]ethanol;2-[(4-amino-1H-indol-7-yl)oxy]ethanol;3-ethyl-2-methyl-7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;3-ethyl-2-methyl-7-(2-pyrrolidin-1-ylethoxy)-1H-indol-4-amine;7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;7-(2-piperidin-1-ylethoxy)-1H-indol-4-amine
SMILESCCc1c(C)[nH]c2c(OCCN3CCCC3)ccc(N)c12.CCc1c(C)[nH]c2c(OCCN3CCOCC3)ccc(N)c12.Nc1ccc(OCCN2CCCCC2)c2[nH]ccc12.Nc1ccc(OCCN2CCOCC2)c2[nH]ccc12.Nc1ccc(OCCO)c2[nH]ccc12.Nc1ccc(OCCO)c2c1ccn2CCO
InChIInChI=1S/C17H25N3O2.C17H25N3O.C15H21N3O.C14H19N3O2.C12H16N2O3.C10H12N2O2/c1-3-13-12(2)19-17-15(5-4-14(18)16(13)17)22-11-8-20-6-9-21-10-7-20;1-3-13-12(2)19-17-15(7-6-14(18)16(13)17)21-11-10-20-8-4-5-9-20;16-13-4-5-14(15-12(13)6-7-17-15)19-11-10-18-8-2-1-3-9-18;15-12-1-2-13(14-11(12)3-4-16-14)19-10-7-17-5-8-18-9-6-17;13-10-1-2-11(17-8-7-16)12-9(10)3-4-14(12)5-6-15;11-8-1-2-9(14-6-5-13)10-7(8)3-4-12-10/h4-5,19H,3,6-11,18H2,1-2H3;6-7,19H,3-5,8-11,18H2,1-2H3;4-7,17H,1-3,8-11,16H2;1-4,16H,5-10,15H2;1-4,15-16H,5-8,13H2;1-4,12-13H,5-6,11H2
InChIKeyAKCMRRDZDSVGBR-UHFFFAOYSA-N
XLogP11.21
TPSA387.49 Ų
H-Bond Donors14
H-Bond Acceptors22
Rotatable Bonds26
Heavy Atoms112
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001539.98
LogP ≤ 511.21
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

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

Analyze 2-[4-amino-7-(2-hydroxyethoxy)indol-1-yl]ethanol;2-[(4-amino-1H-indol-7-yl)oxy]ethanol;3-ethyl-2-methyl-7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;3-ethyl-2-methyl-7-(2-pyrrolidin-1-ylethoxy)-1H-indol-4-amine;7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;7-(2-piperidin-1-ylethoxy)-1H-indol-4-amine with MolForge

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Related Compounds

3-[[6-[bis(5-phenylmethoxy-1H-indol-3-yl)methyl]-2-pyridinyl]-(5-phenylmethoxy-1H-indol-3-yl)methyl]-5-phenylmethoxy-1H-indole
CID 127035684
1-[5-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-pyridinyl]-N-[4-[9,18,27-triethyl-14,23-bis[4-[[5-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-pyridinyl]methylideneamino]phenyl]-9,18,27-triazaheptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1(20),2(10),3(8),4,6,11(19),12(17),13,15,21(26),22,24-dodecaen-5-yl]phenyl]methanimine
CID 154721327
yazh-121D
CID 168328914
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
1-[2-(7-methoxy-1H-indol-3-yl)ethyl]-2-[2-(5-methoxy-2-methyl-1H-indol-3-yl)ethyl]-1,2-bis[(3-phenoxyphenyl)methyl]hydrazine
CID 69838745
10,12,13,23-tetrakis(8-methoxyquinolin-7-yl)-21H-porphyrin
CID 88499124
N-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine;N-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]piperidin-4-amine;1-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]pyrrolidin-3-ol
CID 88962022
5-[4-[[3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1H-indol-7-yl]oxymethyl]phenyl]-3,3-dimethyl-2-(1-methylindol-3-yl)-1,2-dihydroindole
CID 123521716
3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1-methylindole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-phenylmethoxy-1H-indole
CID 144941270
4-N-(6,7-dihydro-5H-cyclopenta[b]pyridin-4-yl)-1-N-[2-(1H-indol-3-yl)ethyl]benzene-1,4-diamine;5-[[2-(hydroxymethyl)-4-pyridinyl]amino]-2-[2-(6-methoxy-1H-indol-3-yl)ethylamino]phenol;1-N-[2-(1H-indol-3-yl)ethyl]-4-N-(8-methoxyquinolin-4-yl)benzene-1,4-diamine;1-N-[2-(1H-indol-3-yl)ethyl]-4-N-pyridin-4-ylbenzene-1,4-diamine;1-N-[2-(1H-indol-3-yl)ethyl]-4-N-quinolin-4-ylbenzene-1,4-diamine;1-N-[2-(1H-indol-3-yl)ethyl]-4-N-(5,6,7,8-tetrahydroquinolin-4-yl)benzene-1,4-diamine;propane
CID 157118007
N,N'-bis[2-(5-ethoxy-1H-indol-3-yl)ethyl]propanediamide;N,N'-bis[2-(5-ethoxy-1H-indol-3-yl)ethyl]propane-1,3-diamine;bis(2-(7-ethoxy-1H-indol-3-yl)ethanamine);pentakis(5-ethoxy-3-propyl-1H-indole);bis(2-(4-propoxy-1H-indol-3-yl)ethanamine);tetrahydrochloride
CID 157218939
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

Frequently Asked Questions

What is the IUPAC name of 2-[4-amino-7-(2-hydroxyethoxy)indol-1-yl]ethanol;2-[(4-amino-1H-indol-7-yl)oxy]ethanol;3-ethyl-2-methyl-7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;3-ethyl-2-methyl-7-(2-pyrrolidin-1-ylethoxy)-1H-indol-4-amine;7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;7-(2-piperidin-1-ylethoxy)-1H-indol-4-amine?
The IUPAC name of 2-[4-amino-7-(2-hydroxyethoxy)indol-1-yl]ethanol;2-[(4-amino-1H-indol-7-yl)oxy]ethanol;3-ethyl-2-methyl-7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;3-ethyl-2-methyl-7-(2-pyrrolidin-1-ylethoxy)-1H-indol-4-amine;7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;7-(2-piperidin-1-ylethoxy)-1H-indol-4-amine (CID 157140266) is 2-[4-amino-7-(2-hydroxyethoxy)indol-1-yl]ethanol;2-[(4-amino-1H-indol-7-yl)oxy]ethanol;3-ethyl-2-methyl-7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;3-ethyl-2-methyl-7-(2-pyrrolidin-1-ylethoxy)-1H-indol-4-amine;7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;7-(2-piperidin-1-ylethoxy)-1H-indol-4-amine.
What is the SMILES notation for 2-[4-amino-7-(2-hydroxyethoxy)indol-1-yl]ethanol;2-[(4-amino-1H-indol-7-yl)oxy]ethanol;3-ethyl-2-methyl-7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;3-ethyl-2-methyl-7-(2-pyrrolidin-1-ylethoxy)-1H-indol-4-amine;7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;7-(2-piperidin-1-ylethoxy)-1H-indol-4-amine?
The canonical SMILES for 2-[4-amino-7-(2-hydroxyethoxy)indol-1-yl]ethanol;2-[(4-amino-1H-indol-7-yl)oxy]ethanol;3-ethyl-2-methyl-7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;3-ethyl-2-methyl-7-(2-pyrrolidin-1-ylethoxy)-1H-indol-4-amine;7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;7-(2-piperidin-1-ylethoxy)-1H-indol-4-amine is CCc1c(C)[nH]c2c(OCCN3CCCC3)ccc(N)c12.CCc1c(C)[nH]c2c(OCCN3CCOCC3)ccc(N)c12.Nc1ccc(OCCN2CCCCC2)c2[nH]ccc12.Nc1ccc(OCCN2CCOCC2)c2[nH]ccc12.Nc1ccc(OCCO)c2[nH]ccc12.Nc1ccc(OCCO)c2c1ccn2CCO.
What is the InChIKey of 2-[4-amino-7-(2-hydroxyethoxy)indol-1-yl]ethanol;2-[(4-amino-1H-indol-7-yl)oxy]ethanol;3-ethyl-2-methyl-7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;3-ethyl-2-methyl-7-(2-pyrrolidin-1-ylethoxy)-1H-indol-4-amine;7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;7-(2-piperidin-1-ylethoxy)-1H-indol-4-amine?
The InChIKey is AKCMRRDZDSVGBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2.C17H25N3O.C15H21N3O.C14H19N3O2.C12H16N2O3.C10H12N2O2/c1-3-13-12(2)19-17-15(5-4-14(18)16(13)17)22-11-8-20-6-9-21-10-7-20;1-3-13-12(2)19-17-15(7-6-14(18)16(13)17)21-11-10-20-8-4-5-9-20;16-13-4-5-14(15-12(13)6-7-17-15)19-11-10-18-8-2-1-3-9-18;15-12-1-2-13(14-11(12)3-4-16-14)19-10-7-17-5-8-18-9-6-17;13-10-1-2-11(17-8-7-16)12-9(10)3-4-14(12)5-6-15;11-8-1-2-9(14-6-5-13)10-7(8)3-4-12-10/h4-5,19H,3,6-11,18H2,1-2H3;6-7,19H,3-5,8-11,18H2,1-2H3;4-7,17H,1-3,8-11,16H2;1-4,16H,5-10,15H2;1-4,15-16H,5-8,13H2;1-4,12-13H,5-6,11H2.
What are the key properties of 2-[4-amino-7-(2-hydroxyethoxy)indol-1-yl]ethanol;2-[(4-amino-1H-indol-7-yl)oxy]ethanol;3-ethyl-2-methyl-7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;3-ethyl-2-methyl-7-(2-pyrrolidin-1-ylethoxy)-1H-indol-4-amine;7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;7-(2-piperidin-1-ylethoxy)-1H-indol-4-amine?
2-[4-amino-7-(2-hydroxyethoxy)indol-1-yl]ethanol;2-[(4-amino-1H-indol-7-yl)oxy]ethanol;3-ethyl-2-methyl-7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;3-ethyl-2-methyl-7-(2-pyrrolidin-1-ylethoxy)-1H-indol-4-amine;7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;7-(2-piperidin-1-ylethoxy)-1H-indol-4-amine has a molecular weight of 1539.98 g/mol, XLogP of 11.21, 26 rotatable bonds, 14 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-amino-7-(2-hydroxyethoxy)indol-1-yl]ethanol;2-[(4-amino-1H-indol-7-yl)oxy]ethanol;3-ethyl-2-methyl-7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;3-ethyl-2-methyl-7-(2-pyrrolidin-1-ylethoxy)-1H-indol-4-amine;7-(2-morpholin-4-ylethoxy)-1H-indol-4-amine;7-(2-piperidin-1-ylethoxy)-1H-indol-4-amine is sourced from PubChem (CID 157140266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).