5-chloro-2-methyl-1H-indole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine

C105H111ClN28O2S2 — CID 161070511

IUPAC5-chloro-2-methyl-1H-indole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine
SMILESCc1cc2c(N)nccc2[nH]1.Cc1cc2c(N)nccc2o1.Cc1cc2c(N)nccc2s1.Cc1cc2cc(Cl)ccc2[nH]1.Cc1cc2ccnc(N)c2[nH]1.Cc1cc2ccnc(N)c2o1.Cc1cc2ccnc(N)c2s1.Cc1ccc2[nH]ncc2c1.Cc1ccc2c(c1)CCN2.Cc1ccc2c(c1)NCC2.Cc1ccc2cn[nH]c2c1.Cc1ccc2n[nH]nc2c1.Cc1nc2c(N)nccc2[nH]1
InChIInChI=1S/C9H8ClN.2C9H11N.2C8H9N3.2C8H8N2O.2C8H8N2S.2C8H8N2.C7H8N4.C7H7N3/c1-6-4-7-5-8(10)2-3-9(7)11-6;1-7-2-3-9-8(6-7)4-5-10-9;1-7-2-3-8-4-5-10-9(8)6-7;1-5-4-6-7(11-5)2-3-10-8(6)9;1-5-4-6-2-3-10-8(9)7(6)11-5;1-5-4-6-7(11-5)2-3-10-8(6)9;1-5-4-6-2-3-10-8(9)7(6)11-5;1-5-4-6-7(11-5)2-3-10-8(6)9;1-5-4-6-2-3-10-8(9)7(6)11-5;1-6-2-3-8-7(4-6)5-9-10-8;1-6-2-3-7-5-9-10-8(7)4-6;1-4-10-5-2-3-9-7(8)6(5)11-4;1-5-2-3-6-7(4-5)9-10-8-6/h2-5,11H,1H3;2*2-3,6,10H,4-5H2,1H3;2*2-4,11H,1H3,(H2,9,10);4*2-4H,1H3,(H2,9,10);2*2-5H,1H3,(H,9,10);2-3H,1H3,(H2,8,9)(H,10,11);2-4H,1H3,(H,8,9,10)
InChIKeyUEOZICZFMPRDJX-UHFFFAOYSA-N
MW1896.82 g/mol
LogP23.63
Rot. Bonds

About 5-chloro-2-methyl-1H-indole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine

5-chloro-2-methyl-1H-indole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine (PubChem CID 161070511) has the molecular formula C105H111ClN28O2S2 and a molecular weight of 1896.82 g/mol. Its IUPAC name is 5-chloro-2-methyl-1H-indole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine.

Molecular Properties

Compound Name5-chloro-2-methyl-1H-indole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine
PubChem CID161070511
Molecular FormulaC105H111ClN28O2S2
Molecular Weight1896.82 g/mol
Exact Mass1894.86
IUPAC Name5-chloro-2-methyl-1H-indole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine
SMILESCc1cc2c(N)nccc2[nH]1.Cc1cc2c(N)nccc2o1.Cc1cc2c(N)nccc2s1.Cc1cc2cc(Cl)ccc2[nH]1.Cc1cc2ccnc(N)c2[nH]1.Cc1cc2ccnc(N)c2o1.Cc1cc2ccnc(N)c2s1.Cc1ccc2[nH]ncc2c1.Cc1ccc2c(c1)CCN2.Cc1ccc2c(c1)NCC2.Cc1ccc2cn[nH]c2c1.Cc1ccc2n[nH]nc2c1.Cc1nc2c(N)nccc2[nH]1
InChIInChI=1S/C9H8ClN.2C9H11N.2C8H9N3.2C8H8N2O.2C8H8N2S.2C8H8N2.C7H8N4.C7H7N3/c1-6-4-7-5-8(10)2-3-9(7)11-6;1-7-2-3-9-8(6-7)4-5-10-9;1-7-2-3-8-4-5-10-9(8)6-7;1-5-4-6-7(11-5)2-3-10-8(6)9;1-5-4-6-2-3-10-8(9)7(6)11-5;1-5-4-6-7(11-5)2-3-10-8(6)9;1-5-4-6-2-3-10-8(9)7(6)11-5;1-5-4-6-7(11-5)2-3-10-8(6)9;1-5-4-6-2-3-10-8(9)7(6)11-5;1-6-2-3-8-7(4-6)5-9-10-8;1-6-2-3-7-5-9-10-8(7)4-6;1-4-10-5-2-3-9-7(8)6(5)11-4;1-5-2-3-6-7(4-5)9-10-8-6/h2-5,11H,1H3;2*2-3,6,10H,4-5H2,1H3;2*2-4,11H,1H3,(H2,9,10);4*2-4H,1H3,(H2,9,10);2*2-5H,1H3,(H,9,10);2-3H,1H3,(H2,8,9)(H,10,11);2-4H,1H3,(H,8,9,10)
InChIKeyUEOZICZFMPRDJX-UHFFFAOYSA-N
XLogP23.63
TPSA497.69 Ų
H-Bond Donors16
H-Bond Acceptors25
Rotatable Bonds
Heavy Atoms138
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001896.82
LogP ≤ 523.63
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1025

Analyze 5-chloro-2-methyl-1H-indole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-methyl-1H-indole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine?
The IUPAC name of 5-chloro-2-methyl-1H-indole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine (CID 161070511) is 5-chloro-2-methyl-1H-indole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine.
What is the SMILES notation for 5-chloro-2-methyl-1H-indole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine?
The canonical SMILES for 5-chloro-2-methyl-1H-indole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine is Cc1cc2c(N)nccc2[nH]1.Cc1cc2c(N)nccc2o1.Cc1cc2c(N)nccc2s1.Cc1cc2cc(Cl)ccc2[nH]1.Cc1cc2ccnc(N)c2[nH]1.Cc1cc2ccnc(N)c2o1.Cc1cc2ccnc(N)c2s1.Cc1ccc2[nH]ncc2c1.Cc1ccc2c(c1)CCN2.Cc1ccc2c(c1)NCC2.Cc1ccc2cn[nH]c2c1.Cc1ccc2n[nH]nc2c1.Cc1nc2c(N)nccc2[nH]1.
What is the InChIKey of 5-chloro-2-methyl-1H-indole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine?
The InChIKey is UEOZICZFMPRDJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClN.2C9H11N.2C8H9N3.2C8H8N2O.2C8H8N2S.2C8H8N2.C7H8N4.C7H7N3/c1-6-4-7-5-8(10)2-3-9(7)11-6;1-7-2-3-9-8(6-7)4-5-10-9;1-7-2-3-8-4-5-10-9(8)6-7;1-5-4-6-7(11-5)2-3-10-8(6)9;1-5-4-6-2-3-10-8(9)7(6)11-5;1-5-4-6-7(11-5)2-3-10-8(6)9;1-5-4-6-2-3-10-8(9)7(6)11-5;1-5-4-6-7(11-5)2-3-10-8(6)9;1-5-4-6-2-3-10-8(9)7(6)11-5;1-6-2-3-8-7(4-6)5-9-10-8;1-6-2-3-7-5-9-10-8(7)4-6;1-4-10-5-2-3-9-7(8)6(5)11-4;1-5-2-3-6-7(4-5)9-10-8-6/h2-5,11H,1H3;2*2-3,6,10H,4-5H2,1H3;2*2-4,11H,1H3,(H2,9,10);4*2-4H,1H3,(H2,9,10);2*2-5H,1H3,(H,9,10);2-3H,1H3,(H2,8,9)(H,10,11);2-4H,1H3,(H,8,9,10).
What are the key properties of 5-chloro-2-methyl-1H-indole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine?
5-chloro-2-methyl-1H-indole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine has a molecular weight of 1896.82 g/mol, XLogP of 23.63, 0 rotatable bonds, 16 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-methyl-1H-indole;5-methyl-2H-benzotriazole;5-methyl-2,3-dihydro-1H-indole;6-methyl-2,3-dihydro-1H-indole;2-methylfuro[2,3-c]pyridin-7-amine;2-methylfuro[3,2-c]pyridin-4-amine;2-methyl-1H-imidazo[4,5-c]pyridin-4-amine;5-methyl-1H-indazole;6-methyl-1H-indazole;2-methyl-1H-pyrrolo[2,3-c]pyridin-7-amine;2-methyl-1H-pyrrolo[3,2-c]pyridin-4-amine;2-methylthieno[2,3-c]pyridin-7-amine;2-methylthieno[3,2-c]pyridin-4-amine is sourced from PubChem (CID 161070511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).