6-fluoro-1-(oxolan-2-ylmethyl)indole

C13H14FNO — CID 116619846

IUPAC6-fluoro-1-(oxolan-2-ylmethyl)indole
SMILESFc1ccc2ccn(CC3CCCO3)c2c1
InChIInChI=1S/C13H14FNO/c14-11-4-3-10-5-6-15(13(10)8-11)9-12-2-1-7-16-12/h3-6,8,12H,1-2,7,9H2
InChIKeyKUTSMUCVVXQPOK-UHFFFAOYSA-N
MW219.26 g/mol
LogP2.96
Rot. Bonds2

About 6-fluoro-1-(oxolan-2-ylmethyl)indole

6-fluoro-1-(oxolan-2-ylmethyl)indole (PubChem CID 116619846) has the molecular formula C13H14FNO and a molecular weight of 219.26 g/mol. Its IUPAC name is 6-fluoro-1-(oxolan-2-ylmethyl)indole.

Molecular Properties

Compound Name6-fluoro-1-(oxolan-2-ylmethyl)indole
PubChem CID116619846
Molecular FormulaC13H14FNO
Molecular Weight219.26 g/mol
Exact Mass219.11
IUPAC Name6-fluoro-1-(oxolan-2-ylmethyl)indole
SMILESFc1ccc2ccn(CC3CCCO3)c2c1
InChIInChI=1S/C13H14FNO/c14-11-4-3-10-5-6-15(13(10)8-11)9-12-2-1-7-16-12/h3-6,8,12H,1-2,7,9H2
InChIKeyKUTSMUCVVXQPOK-UHFFFAOYSA-N
XLogP2.96
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.26
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 6-fluoro-1-(oxolan-2-ylmethyl)indole 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

1-(oxan-2-ylmethyl)indole-6-carboxylic acid
CID 63936403
N'-hydroxy-1-(oxolan-2-ylmethyl)indole-6-carboximidamide
CID 107917557
1-(oxolan-2-ylmethyl)indole-5-carboxylic acid
CID 63749653
1-(oxan-2-ylmethyl)indole-5-carboxylic acid
CID 63935795
1-(cyclopropylmethyl)-6-(oxolan-2-ylmethyl)pyrrolo[2,3-c]pyridin-7-one
CID 53164582
2-(1-chloroethyl)-6-fluoro-1-(oxolan-2-ylmethyl)benzimidazole
CID 62378406
1-[1-(oxolan-2-ylmethyl)indol-5-yl]butan-2-amine
CID 102917685
[1-[3-(oxolan-2-yl)propyl]indol-6-yl]methanamine
CID 65165019
6-fluoro-3-(oxolan-2-ylmethyl)-1H-benzimidazol-2-one
CID 110491161
2-(2-chloroethyl)-4,6-difluoro-1-(oxolan-2-ylmethyl)benzimidazole
CID 115508990
N-[[1-[2-(oxolan-2-yl)ethyl]indol-6-yl]methyl]cyclopropanamine
CID 65165692
cobalt;1-ethyl-6-fluoroindole
CID 58657570

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-1-(oxolan-2-ylmethyl)indole?
The IUPAC name of 6-fluoro-1-(oxolan-2-ylmethyl)indole (CID 116619846) is 6-fluoro-1-(oxolan-2-ylmethyl)indole.
What is the SMILES notation for 6-fluoro-1-(oxolan-2-ylmethyl)indole?
The canonical SMILES for 6-fluoro-1-(oxolan-2-ylmethyl)indole is Fc1ccc2ccn(CC3CCCO3)c2c1.
What is the InChIKey of 6-fluoro-1-(oxolan-2-ylmethyl)indole?
The InChIKey is KUTSMUCVVXQPOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14FNO/c14-11-4-3-10-5-6-15(13(10)8-11)9-12-2-1-7-16-12/h3-6,8,12H,1-2,7,9H2.
What are the key properties of 6-fluoro-1-(oxolan-2-ylmethyl)indole?
6-fluoro-1-(oxolan-2-ylmethyl)indole has a molecular weight of 219.26 g/mol, XLogP of 2.96, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-1-(oxolan-2-ylmethyl)indole is sourced from PubChem (CID 116619846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).