(2,3-dichlorophenyl)-(1H-indol-4-yl)methanol

C15H11Cl2NO — CID 115351822

IUPAC(2,3-dichlorophenyl)-(1H-indol-4-yl)methanol
SMILESOC(c1cccc(Cl)c1Cl)c1cccc2[nH]ccc12
InChIInChI=1S/C15H11Cl2NO/c16-12-5-1-4-11(14(12)17)15(19)10-3-2-6-13-9(10)7-8-18-13/h1-8,15,18-19H
InChIKeyUAEWABVRTJXHQE-UHFFFAOYSA-N
MW292.17 g/mol
LogP4.56
Rot. Bonds2

About (2,3-dichlorophenyl)-(1H-indol-4-yl)methanol

(2,3-dichlorophenyl)-(1H-indol-4-yl)methanol (PubChem CID 115351822) has the molecular formula C15H11Cl2NO and a molecular weight of 292.17 g/mol. Its IUPAC name is (2,3-dichlorophenyl)-(1H-indol-4-yl)methanol.

Molecular Properties

Compound Name(2,3-dichlorophenyl)-(1H-indol-4-yl)methanol
PubChem CID115351822
Molecular FormulaC15H11Cl2NO
Molecular Weight292.17 g/mol
Exact Mass291.02
IUPAC Name(2,3-dichlorophenyl)-(1H-indol-4-yl)methanol
SMILESOC(c1cccc(Cl)c1Cl)c1cccc2[nH]ccc12
InChIInChI=1S/C15H11Cl2NO/c16-12-5-1-4-11(14(12)17)15(19)10-3-2-6-13-9(10)7-8-18-13/h1-8,15,18-19H
InChIKeyUAEWABVRTJXHQE-UHFFFAOYSA-N
XLogP4.56
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.17
LogP ≤ 54.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

(2,6-dichlorophenyl)-(1H-indol-4-yl)methanol
CID 115351810
(2-chloro-6-fluorophenyl)-(1H-indol-4-yl)methanol
CID 115351816
(4-chloro-2-fluorophenyl)-(1H-indol-4-yl)methanol
CID 114852920
(2-fluorophenyl)-(1H-indol-4-yl)methanol
CID 113292217
4-(2,3-dichlorophenyl)-1H-indole
CID 172647420
1H-indol-4-yl-[2-(trifluoromethyl)phenyl]methanol
CID 115351825
(3,5-dimethylphenyl)-(1H-indol-4-yl)methanol
CID 115351861
2-amino-1-(1H-indol-4-yl)ethanol
CID 13186941
(4-bromonaphthalen-1-yl)-(2,3-dichlorophenyl)methanol
CID 79590685
1H-indol-4-yl-(5-methylthiophen-2-yl)methanol
CID 115351831
(1S,2S)-1-amino-1-(1H-indol-4-yl)propan-2-ol
CID 55273031
(1R,2S)-2-amino-1-(1H-indol-4-yl)propan-1-ol
CID 94841904

Frequently Asked Questions

What is the IUPAC name of (2,3-dichlorophenyl)-(1H-indol-4-yl)methanol?
The IUPAC name of (2,3-dichlorophenyl)-(1H-indol-4-yl)methanol (CID 115351822) is (2,3-dichlorophenyl)-(1H-indol-4-yl)methanol.
What is the SMILES notation for (2,3-dichlorophenyl)-(1H-indol-4-yl)methanol?
The canonical SMILES for (2,3-dichlorophenyl)-(1H-indol-4-yl)methanol is OC(c1cccc(Cl)c1Cl)c1cccc2[nH]ccc12.
What is the InChIKey of (2,3-dichlorophenyl)-(1H-indol-4-yl)methanol?
The InChIKey is UAEWABVRTJXHQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2NO/c16-12-5-1-4-11(14(12)17)15(19)10-3-2-6-13-9(10)7-8-18-13/h1-8,15,18-19H.
What are the key properties of (2,3-dichlorophenyl)-(1H-indol-4-yl)methanol?
(2,3-dichlorophenyl)-(1H-indol-4-yl)methanol has a molecular weight of 292.17 g/mol, XLogP of 4.56, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-dichlorophenyl)-(1H-indol-4-yl)methanol is sourced from PubChem (CID 115351822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).