1-[(3,4-dichlorophenyl)methyl]indol-5-ol

C15H11Cl2NO — CID 151816964

IUPAC1-[(3,4-dichlorophenyl)methyl]indol-5-ol
SMILESOc1ccc2c(ccn2Cc2ccc(Cl)c(Cl)c2)c1
InChIInChI=1S/C15H11Cl2NO/c16-13-3-1-10(7-14(13)17)9-18-6-5-11-8-12(19)2-4-15(11)18/h1-8,19H,9H2
InChIKeySBUOZPOHXOULMM-UHFFFAOYSA-N
MW292.17 g/mol
LogP4.70
Rot. Bonds2

About 1-[(3,4-dichlorophenyl)methyl]indol-5-ol

1-[(3,4-dichlorophenyl)methyl]indol-5-ol (PubChem CID 151816964) has the molecular formula C15H11Cl2NO and a molecular weight of 292.17 g/mol. Its IUPAC name is 1-[(3,4-dichlorophenyl)methyl]indol-5-ol.

Molecular Properties

Compound Name1-[(3,4-dichlorophenyl)methyl]indol-5-ol
PubChem CID151816964
Molecular FormulaC15H11Cl2NO
Molecular Weight292.17 g/mol
Exact Mass291.02
IUPAC Name1-[(3,4-dichlorophenyl)methyl]indol-5-ol
SMILESOc1ccc2c(ccn2Cc2ccc(Cl)c(Cl)c2)c1
InChIInChI=1S/C15H11Cl2NO/c16-13-3-1-10(7-14(13)17)9-18-6-5-11-8-12(19)2-4-15(11)18/h1-8,19H,9H2
InChIKeySBUOZPOHXOULMM-UHFFFAOYSA-N
XLogP4.70
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.17
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(3,4-dichlorophenyl)methyl]-2-methylindol-5-ol
CID 174670552
1-[(4-methyl-3-nitrophenyl)methyl]indol-5-ol
CID 139959961
1-[(3,4-dichlorophenyl)methyl]indole-6-carbothioamide
CID 107917320
5-bromo-1-[(3-chloro-4-fluorophenyl)methyl]indole
CID 103041480
4-[(5-chloroindol-1-yl)methyl]benzoic acid
CID 63879545
1-[(4-chloro-3-fluorophenyl)methyl]indole-5-carbothioamide
CID 107920577
5-chloro-1-[(3,4-dimethylphenyl)methyl]indole
CID 116623337
1-[[4-(3-piperidin-1-ylpropoxy)phenyl]methyl]indol-5-ol
CID 140981807
4-[[6-(hydroxymethyl)indol-1-yl]methyl]phenol
CID 102913078
[1-[(4-ethylphenyl)methyl]indol-5-yl]methanol
CID 102912425
4-bromo-1-[(3,4-dichlorophenyl)methyl]indole
CID 116626065
1-[(3,4-dichlorophenyl)methyl]-4-methylindole
CID 116620210

Frequently Asked Questions

What is the IUPAC name of 1-[(3,4-dichlorophenyl)methyl]indol-5-ol?
The IUPAC name of 1-[(3,4-dichlorophenyl)methyl]indol-5-ol (CID 151816964) is 1-[(3,4-dichlorophenyl)methyl]indol-5-ol.
What is the SMILES notation for 1-[(3,4-dichlorophenyl)methyl]indol-5-ol?
The canonical SMILES for 1-[(3,4-dichlorophenyl)methyl]indol-5-ol is Oc1ccc2c(ccn2Cc2ccc(Cl)c(Cl)c2)c1.
What is the InChIKey of 1-[(3,4-dichlorophenyl)methyl]indol-5-ol?
The InChIKey is SBUOZPOHXOULMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2NO/c16-13-3-1-10(7-14(13)17)9-18-6-5-11-8-12(19)2-4-15(11)18/h1-8,19H,9H2.
What are the key properties of 1-[(3,4-dichlorophenyl)methyl]indol-5-ol?
1-[(3,4-dichlorophenyl)methyl]indol-5-ol has a molecular weight of 292.17 g/mol, XLogP of 4.70, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3,4-dichlorophenyl)methyl]indol-5-ol is sourced from PubChem (CID 151816964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).