2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;2,3-dimethyl-7-(2-pyrrol-1-ylethoxy)-1H-indol-4-amine;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-1H-indol-4-amine;7-methyl-1H-indol-4-amine

C82H103N15O7 — CID 157310709

IUPAC2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;2,3-dimethyl-7-(2-pyrrol-1-ylethoxy)-1H-indol-4-amine;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-1H-indol-4-amine;7-methyl-1H-indol-4-amine
SMILESCCc1ccc(N)c2cc[nH]c12.COCCOc1ccc(N)c2c(C)c(C)[nH]c12.COCCOc1ccc(N)c2cc[nH]c12.Cc1[nH]c2c(OCCn3cccc3)ccc(N)c2c1C.Cc1ccc(N)c2c(CCCO)c[nH]c12.Cc1ccc(N)c2c(CCO)c[nH]c12.Cc1ccc(N)c2cc[nH]c12
InChIInChI=1S/C16H19N3O.C13H18N2O2.C12H16N2O.C11H14N2O2.C11H14N2O.C10H12N2.C9H10N2/c1-11-12(2)18-16-14(6-5-13(17)15(11)16)20-10-9-19-7-3-4-8-19;1-8-9(2)15-13-11(17-7-6-16-3)5-4-10(14)12(8)13;1-8-4-5-10(13)11-9(3-2-6-15)7-14-12(8)11;1-14-6-7-15-10-3-2-9(12)8-4-5-13-11(8)10;1-7-2-3-9(12)10-8(4-5-14)6-13-11(7)10;1-2-7-3-4-9(11)8-5-6-12-10(7)8;1-6-2-3-8(10)7-4-5-11-9(6)7/h3-8,18H,9-10,17H2,1-2H3;4-5,15H,6-7,14H2,1-3H3;4-5,7,14-15H,2-3,6,13H2,1H3;2-5,13H,6-7,12H2,1H3;2-3,6,13-14H,4-5,12H2,1H3;3-6,12H,2,11H2,1H3;2-5,11H,10H2,1H3
InChIKeyBCZVZQCTHUBCQP-UHFFFAOYSA-N
MW1410.82 g/mol
LogP15.36
Rot. Bonds18

About 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;2,3-dimethyl-7-(2-pyrrol-1-ylethoxy)-1H-indol-4-amine;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-1H-indol-4-amine;7-methyl-1H-indol-4-amine

2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;2,3-dimethyl-7-(2-pyrrol-1-ylethoxy)-1H-indol-4-amine;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-1H-indol-4-amine;7-methyl-1H-indol-4-amine (PubChem CID 157310709) has the molecular formula C82H103N15O7 and a molecular weight of 1410.82 g/mol. Its IUPAC name is 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;2,3-dimethyl-7-(2-pyrrol-1-ylethoxy)-1H-indol-4-amine;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-1H-indol-4-amine;7-methyl-1H-indol-4-amine.

Molecular Properties

Compound Name2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;2,3-dimethyl-7-(2-pyrrol-1-ylethoxy)-1H-indol-4-amine;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-1H-indol-4-amine;7-methyl-1H-indol-4-amine
PubChem CID157310709
Molecular FormulaC82H103N15O7
Molecular Weight1410.82 g/mol
Exact Mass1409.82
IUPAC Name2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;2,3-dimethyl-7-(2-pyrrol-1-ylethoxy)-1H-indol-4-amine;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-1H-indol-4-amine;7-methyl-1H-indol-4-amine
SMILESCCc1ccc(N)c2cc[nH]c12.COCCOc1ccc(N)c2c(C)c(C)[nH]c12.COCCOc1ccc(N)c2cc[nH]c12.Cc1[nH]c2c(OCCn3cccc3)ccc(N)c2c1C.Cc1ccc(N)c2c(CCCO)c[nH]c12.Cc1ccc(N)c2c(CCO)c[nH]c12.Cc1ccc(N)c2cc[nH]c12
InChIInChI=1S/C16H19N3O.C13H18N2O2.C12H16N2O.C11H14N2O2.C11H14N2O.C10H12N2.C9H10N2/c1-11-12(2)18-16-14(6-5-13(17)15(11)16)20-10-9-19-7-3-4-8-19;1-8-9(2)15-13-11(17-7-6-16-3)5-4-10(14)12(8)13;1-8-4-5-10(13)11-9(3-2-6-15)7-14-12(8)11;1-14-6-7-15-10-3-2-9(12)8-4-5-13-11(8)10;1-7-2-3-9(12)10-8(4-5-14)6-13-11(7)10;1-2-7-3-4-9(11)8-5-6-12-10(7)8;1-6-2-3-8(10)7-4-5-11-9(6)7/h3-8,18H,9-10,17H2,1-2H3;4-5,15H,6-7,14H2,1-3H3;4-5,7,14-15H,2-3,6,13H2,1H3;2-5,13H,6-7,12H2,1H3;2-3,6,13-14H,4-5,12H2,1H3;3-6,12H,2,11H2,1H3;2-5,11H,10H2,1H3
InChIKeyBCZVZQCTHUBCQP-UHFFFAOYSA-N
XLogP15.36
TPSA384.21 Ų
H-Bond Donors16
H-Bond Acceptors15
Rotatable Bonds18
Heavy Atoms104
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001410.82
LogP ≤ 515.36
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

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

Analyze 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;2,3-dimethyl-7-(2-pyrrol-1-ylethoxy)-1H-indol-4-amine;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-1H-indol-4-amine;7-methyl-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
5,12,22,32-Tetramethyl-19-oxa-1,8,14,30-tetrazanonacyclo[18.15.0.02,18.03,15.04,13.06,11.021,33.023,31.024,29]pentatriaconta-2(18),3(15),4(13),5,7,9,11,16,21,23(31),24,26,28,32-tetradecaene
CID 102599342
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
1-[2-(4,6-difluoro-5-methoxy-1-methylindol-3-yl)ethyl]-2-[2-(7-methoxy-1H-indol-3-yl)ethyl]-2-[(3-phenoxyphenyl)methyl]-1-[[3-(2,2,2-trifluoroethoxy)phenyl]methyl]hydrazine
CID 91137631
3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-6-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;5-fluoro-3-(1H-indol-2-yl)-1H-indole;2-(1H-indol-3-yl)-3,3-dimethyl-1,2-dihydroindole;2-(1H-indol-3-yl)-3,3-dimethylindole;2-(1H-indol-3-yl)spiro[1,2-dihydroindole-3,1'-cyclohexane];2-(1H-indol-3-yl)-5-(trifluoromethyl)-1H-indole;2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline;3-spiro[1,2-dihydroindole-3,1'-cyclohexane]-2-yl-1H-indol-7-ol
CID 160972000
5-(naphthalen-2-ylmethoxy)-3-propyl-1H-indole;5-(naphthalen-2-ylmethoxy)-3-propyl-1-[[4-(trifluoromethyl)phenyl]methyl]indole;2-[5-(naphthalen-2-ylmethoxy)-1-[[4-(trifluoromethyl)phenyl]methyl]indol-3-yl]ethanamine;3-propyl-1H-indol-5-ol
CID 161988064
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
(2S)-2-[[[4-[[4-[2-[2-[2-[2-[[4-[4-[N-[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]-C-hydroxycarbonimidoyl]-2-[2-(1H-indol-3-yl)ethoxy]phenyl]imino-1,4-dihydroxybutylidene]amino]ethoxy]ethoxy]ethoxy]ethylimino]-1,4-dihydroxybutylidene]amino]-3-[2-(1H-indol-3-yl)ethoxy]phenyl]-hydroxymethylidene]amino]-3-(1H-indol-3-yl)propanoic acid
CID 132547207
1-methoxy-9-[(1-methoxy-9H-carbazol-3-yl)methyl]-3-[(1-methoxy-3-methylcarbazol-9-yl)methyl]carbazole
CID 102015823
[3-[4-(5-methoxy-4-piperidin-1-ylindol-1-yl)butyl]-1H-indol-5-yl]methanol
CID 67713491
[3-[3-(5-methoxy-4-piperidin-1-ylindol-1-yl)propyl]-1H-indol-5-yl]methanol
CID 67713549
3-[[1-(2-fluoro-2-phenoxyethyl)-3,6-dihydro-2H-pyridin-5-yl]methyl]-5-methoxy-1H-indole;4-[2-[5-[(5-methoxy-1H-indol-3-yl)methyl]-3,6-dihydro-2H-pyridin-1-yl]ethyl]aniline
CID 67763864

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;2,3-dimethyl-7-(2-pyrrol-1-ylethoxy)-1H-indol-4-amine;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-1H-indol-4-amine;7-methyl-1H-indol-4-amine?
The IUPAC name of 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;2,3-dimethyl-7-(2-pyrrol-1-ylethoxy)-1H-indol-4-amine;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-1H-indol-4-amine;7-methyl-1H-indol-4-amine (CID 157310709) is 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;2,3-dimethyl-7-(2-pyrrol-1-ylethoxy)-1H-indol-4-amine;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-1H-indol-4-amine;7-methyl-1H-indol-4-amine.
What is the SMILES notation for 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;2,3-dimethyl-7-(2-pyrrol-1-ylethoxy)-1H-indol-4-amine;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-1H-indol-4-amine;7-methyl-1H-indol-4-amine?
The canonical SMILES for 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;2,3-dimethyl-7-(2-pyrrol-1-ylethoxy)-1H-indol-4-amine;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-1H-indol-4-amine;7-methyl-1H-indol-4-amine is CCc1ccc(N)c2cc[nH]c12.COCCOc1ccc(N)c2c(C)c(C)[nH]c12.COCCOc1ccc(N)c2cc[nH]c12.Cc1[nH]c2c(OCCn3cccc3)ccc(N)c2c1C.Cc1ccc(N)c2c(CCCO)c[nH]c12.Cc1ccc(N)c2c(CCO)c[nH]c12.Cc1ccc(N)c2cc[nH]c12.
What is the InChIKey of 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;2,3-dimethyl-7-(2-pyrrol-1-ylethoxy)-1H-indol-4-amine;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-1H-indol-4-amine;7-methyl-1H-indol-4-amine?
The InChIKey is BCZVZQCTHUBCQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O.C13H18N2O2.C12H16N2O.C11H14N2O2.C11H14N2O.C10H12N2.C9H10N2/c1-11-12(2)18-16-14(6-5-13(17)15(11)16)20-10-9-19-7-3-4-8-19;1-8-9(2)15-13-11(17-7-6-16-3)5-4-10(14)12(8)13;1-8-4-5-10(13)11-9(3-2-6-15)7-14-12(8)11;1-14-6-7-15-10-3-2-9(12)8-4-5-13-11(8)10;1-7-2-3-9(12)10-8(4-5-14)6-13-11(7)10;1-2-7-3-4-9(11)8-5-6-12-10(7)8;1-6-2-3-8(10)7-4-5-11-9(6)7/h3-8,18H,9-10,17H2,1-2H3;4-5,15H,6-7,14H2,1-3H3;4-5,7,14-15H,2-3,6,13H2,1H3;2-5,13H,6-7,12H2,1H3;2-3,6,13-14H,4-5,12H2,1H3;3-6,12H,2,11H2,1H3;2-5,11H,10H2,1H3.
What are the key properties of 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;2,3-dimethyl-7-(2-pyrrol-1-ylethoxy)-1H-indol-4-amine;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-1H-indol-4-amine;7-methyl-1H-indol-4-amine?
2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;2,3-dimethyl-7-(2-pyrrol-1-ylethoxy)-1H-indol-4-amine;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-1H-indol-4-amine;7-methyl-1H-indol-4-amine has a molecular weight of 1410.82 g/mol, XLogP of 15.36, 18 rotatable bonds, 16 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;2,3-dimethyl-7-(2-pyrrol-1-ylethoxy)-1H-indol-4-amine;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-1H-indol-4-amine;7-methyl-1H-indol-4-amine is sourced from PubChem (CID 157310709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).