[6-chloro-1-[(5-fluoro-2-methylphenyl)methyl]indol-3-yl]methanol

C17H15ClFNO — CID 105372625

IUPAC[6-chloro-1-[(5-fluoro-2-methylphenyl)methyl]indol-3-yl]methanol
SMILESCc1ccc(F)cc1Cn1cc(CO)c2ccc(Cl)cc21
InChIInChI=1S/C17H15ClFNO/c1-11-2-4-15(19)6-12(11)8-20-9-13(10-21)16-5-3-14(18)7-17(16)20/h2-7,9,21H,8,10H2,1H3
InChIKeyGLDNRUCQFOBAPW-UHFFFAOYSA-N
MW303.76 g/mol
LogP4.28
Rot. Bonds3

About [6-chloro-1-[(5-fluoro-2-methylphenyl)methyl]indol-3-yl]methanol

[6-chloro-1-[(5-fluoro-2-methylphenyl)methyl]indol-3-yl]methanol (PubChem CID 105372625) has the molecular formula C17H15ClFNO and a molecular weight of 303.76 g/mol. Its IUPAC name is [6-chloro-1-[(5-fluoro-2-methylphenyl)methyl]indol-3-yl]methanol.

Molecular Properties

Compound Name[6-chloro-1-[(5-fluoro-2-methylphenyl)methyl]indol-3-yl]methanol
PubChem CID105372625
Molecular FormulaC17H15ClFNO
Molecular Weight303.76 g/mol
Exact Mass303.08
IUPAC Name[6-chloro-1-[(5-fluoro-2-methylphenyl)methyl]indol-3-yl]methanol
SMILESCc1ccc(F)cc1Cn1cc(CO)c2ccc(Cl)cc21
InChIInChI=1S/C17H15ClFNO/c1-11-2-4-15(19)6-12(11)8-20-9-13(10-21)16-5-3-14(18)7-17(16)20/h2-7,9,21H,8,10H2,1H3
InChIKeyGLDNRUCQFOBAPW-UHFFFAOYSA-N
XLogP4.28
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.76
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [6-chloro-1-[(5-fluoro-2-methylphenyl)methyl]indol-3-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[6-chloro-1-[(5-fluoro-2-methylphenyl)methyl]indol-3-yl]methanamine
CID 105372683
[1-[(5-chloro-2-methoxyphenyl)methyl]indol-3-yl]methanol
CID 66398877
[1-[(2,5-dichlorophenyl)methyl]indol-3-yl]methanol
CID 66399928
6-[6-chloro-3-(hydroxymethyl)indol-1-yl]hexan-1-ol
CID 107705771
5-chloro-1-[(2-chloro-4-fluorophenyl)methyl]-3-methylindole
CID 142538843
[6-chloro-1-(2,2,2-trifluoroethoxymethyl)indol-3-yl]methanol
CID 106705438
[1-[(5-fluoro-2-methylphenyl)methyl]imidazol-4-yl]methanol
CID 106717550
6-chloro-1-[(4-fluorophenyl)methyl]-3-[(E)-2-(4-methylphenyl)ethenyl]indole
CID 122449152
[6-chloro-1-(cyclopropylmethoxymethyl)indol-3-yl]methanol
CID 106930114
2-[1-[(2-chloro-5-fluorophenyl)methyl]indol-3-yl]ethanamine
CID 102620112
2-[1-[(5-fluoro-2-methylphenyl)methyl]indol-4-yl]ethanamine
CID 105375151
1-[(5-fluoro-2-methylphenyl)methyl]indole-4-carbaldehyde
CID 105372599

Frequently Asked Questions

What is the IUPAC name of [6-chloro-1-[(5-fluoro-2-methylphenyl)methyl]indol-3-yl]methanol?
The IUPAC name of [6-chloro-1-[(5-fluoro-2-methylphenyl)methyl]indol-3-yl]methanol (CID 105372625) is [6-chloro-1-[(5-fluoro-2-methylphenyl)methyl]indol-3-yl]methanol.
What is the SMILES notation for [6-chloro-1-[(5-fluoro-2-methylphenyl)methyl]indol-3-yl]methanol?
The canonical SMILES for [6-chloro-1-[(5-fluoro-2-methylphenyl)methyl]indol-3-yl]methanol is Cc1ccc(F)cc1Cn1cc(CO)c2ccc(Cl)cc21.
What is the InChIKey of [6-chloro-1-[(5-fluoro-2-methylphenyl)methyl]indol-3-yl]methanol?
The InChIKey is GLDNRUCQFOBAPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClFNO/c1-11-2-4-15(19)6-12(11)8-20-9-13(10-21)16-5-3-14(18)7-17(16)20/h2-7,9,21H,8,10H2,1H3.
What are the key properties of [6-chloro-1-[(5-fluoro-2-methylphenyl)methyl]indol-3-yl]methanol?
[6-chloro-1-[(5-fluoro-2-methylphenyl)methyl]indol-3-yl]methanol has a molecular weight of 303.76 g/mol, XLogP of 4.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [6-chloro-1-[(5-fluoro-2-methylphenyl)methyl]indol-3-yl]methanol is sourced from PubChem (CID 105372625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).