[1-[(3-methoxyphenyl)methyl]-3-(6-methoxy-3-pyridinyl)-5-methylindol-2-yl]methanol

C24H24N2O3 — CID 118967126

IUPAC[1-[(3-methoxyphenyl)methyl]-3-(6-methoxy-3-pyridinyl)-5-methylindol-2-yl]methanol
SMILESCOc1cccc(Cn2c(CO)c(-c3ccc(OC)nc3)c3cc(C)ccc32)c1
InChIInChI=1S/C24H24N2O3/c1-16-7-9-21-20(11-16)24(18-8-10-23(29-3)25-13-18)22(15-27)26(21)14-17-5-4-6-19(12-17)28-2/h4-13,27H,14-15H2,1-3H3
InChIKeyAFYVEFNWRPYQBL-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.57
Rot. Bonds6

About [1-[(3-methoxyphenyl)methyl]-3-(6-methoxy-3-pyridinyl)-5-methylindol-2-yl]methanol

[1-[(3-methoxyphenyl)methyl]-3-(6-methoxy-3-pyridinyl)-5-methylindol-2-yl]methanol (PubChem CID 118967126) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is [1-[(3-methoxyphenyl)methyl]-3-(6-methoxy-3-pyridinyl)-5-methylindol-2-yl]methanol.

Molecular Properties

Compound Name[1-[(3-methoxyphenyl)methyl]-3-(6-methoxy-3-pyridinyl)-5-methylindol-2-yl]methanol
PubChem CID118967126
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC Name[1-[(3-methoxyphenyl)methyl]-3-(6-methoxy-3-pyridinyl)-5-methylindol-2-yl]methanol
SMILESCOc1cccc(Cn2c(CO)c(-c3ccc(OC)nc3)c3cc(C)ccc32)c1
InChIInChI=1S/C24H24N2O3/c1-16-7-9-21-20(11-16)24(18-8-10-23(29-3)25-13-18)22(15-27)26(21)14-17-5-4-6-19(12-17)28-2/h4-13,27H,14-15H2,1-3H3
InChIKeyAFYVEFNWRPYQBL-UHFFFAOYSA-N
XLogP4.57
TPSA56.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[1-benzyl-3-(6-methoxy-3-pyridinyl)-6-propan-2-yloxyindol-2-yl]methanol
CID 118967156
[1-benzyl-3-(6-methoxy-3-pyridinyl)-5-(trifluoromethoxy)indol-2-yl]methanol;[1-[(3-bromophenyl)methyl]-3-(6-methoxy-3-pyridinyl)-5-(trifluoromethoxy)indol-2-yl]methanol;[1-[(3-fluoro-5-methylphenyl)methyl]-3-(6-methoxy-3-pyridinyl)-5-(trifluoromethoxy)indol-2-yl]methanol;[1-[(2-fluorophenyl)methyl]-3-(6-methoxy-3-pyridinyl)-5-(trifluoromethoxy)indol-2-yl]methanol
CID 159542441
[3-[4-(cyclopropylmethoxy)phenyl]-1-[(3-methoxyphenyl)methyl]indol-2-yl]methanol
CID 142136286
[1-[(2-chlorophenyl)methyl]-3-(6-methoxy-3-pyridinyl)-5-(trifluoromethoxy)indol-2-yl]methanol
CID 118967091
1-[(4-cyano-2-fluorophenyl)methyl]-2-(hydroxymethyl)-3-(6-methoxy-3-pyridinyl)indole-5-carbonitrile
CID 118967146
[1-[(2-chlorophenyl)methyl]-3-(2-fluoropyrimidin-5-yl)-5-methoxyindol-2-yl]methanol
CID 118967097
3-benzyl-5-[(3-methoxyphenyl)methyl]-8-methylpyrimido[5,4-b]indol-4-one
CID 53026559
6-methoxy-9-[(3-methoxyphenyl)methyl]pyrido[3,4-b]indole
CID 134505246
[1-[(2-chlorophenyl)methyl]-3-(2-fluoropyrimidin-5-yl)-5-methoxyindol-2-yl]methanol;[1-[(2-chlorophenyl)methyl]-5-methoxy-3-(2-methoxypyrimidin-5-yl)indol-2-yl]methanol;[1-[(2-chlorophenyl)methyl]-5-methoxy-3-pyrimidin-5-ylindol-2-yl]methanol;[1-[(2-fluoro-4-methylphenyl)methyl]-5-methoxy-3-(2-methoxypyrimidin-5-yl)indol-2-yl]methanol
CID 161335033
7-(4-fluorophenyl)-1-[(3-methoxyphenyl)methyl]-2,3-dimethylpyrrolo[2,3-c]pyridine
CID 67141832
6-methoxy-9-[(4-methylphenyl)methyl]pyrido[3,4-b]indole
CID 170621370
(3-methoxyphenyl)(113C)methanol
CID 11593446

Frequently Asked Questions

What is the IUPAC name of [1-[(3-methoxyphenyl)methyl]-3-(6-methoxy-3-pyridinyl)-5-methylindol-2-yl]methanol?
The IUPAC name of [1-[(3-methoxyphenyl)methyl]-3-(6-methoxy-3-pyridinyl)-5-methylindol-2-yl]methanol (CID 118967126) is [1-[(3-methoxyphenyl)methyl]-3-(6-methoxy-3-pyridinyl)-5-methylindol-2-yl]methanol.
What is the SMILES notation for [1-[(3-methoxyphenyl)methyl]-3-(6-methoxy-3-pyridinyl)-5-methylindol-2-yl]methanol?
The canonical SMILES for [1-[(3-methoxyphenyl)methyl]-3-(6-methoxy-3-pyridinyl)-5-methylindol-2-yl]methanol is COc1cccc(Cn2c(CO)c(-c3ccc(OC)nc3)c3cc(C)ccc32)c1.
What is the InChIKey of [1-[(3-methoxyphenyl)methyl]-3-(6-methoxy-3-pyridinyl)-5-methylindol-2-yl]methanol?
The InChIKey is AFYVEFNWRPYQBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-16-7-9-21-20(11-16)24(18-8-10-23(29-3)25-13-18)22(15-27)26(21)14-17-5-4-6-19(12-17)28-2/h4-13,27H,14-15H2,1-3H3.
What are the key properties of [1-[(3-methoxyphenyl)methyl]-3-(6-methoxy-3-pyridinyl)-5-methylindol-2-yl]methanol?
[1-[(3-methoxyphenyl)methyl]-3-(6-methoxy-3-pyridinyl)-5-methylindol-2-yl]methanol has a molecular weight of 388.47 g/mol, XLogP of 4.57, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(3-methoxyphenyl)methyl]-3-(6-methoxy-3-pyridinyl)-5-methylindol-2-yl]methanol is sourced from PubChem (CID 118967126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).