(6-fluoro-3-propan-2-yl-2,3-dihydro-1H-indol-2-yl)methanol

C12H16FNO — CID 83916718

IUPAC(6-fluoro-3-propan-2-yl-2,3-dihydro-1H-indol-2-yl)methanol
SMILESCC(C)C1c2ccc(F)cc2NC1CO
InChIInChI=1S/C12H16FNO/c1-7(2)12-9-4-3-8(13)5-10(9)14-11(12)6-15/h3-5,7,11-12,14-15H,6H2,1-2H3
InChIKeyGPTWFDDJZNQYIP-UHFFFAOYSA-N
MW209.26 g/mol
LogP2.35
Rot. Bonds2

About (6-fluoro-3-propan-2-yl-2,3-dihydro-1H-indol-2-yl)methanol

(6-fluoro-3-propan-2-yl-2,3-dihydro-1H-indol-2-yl)methanol (PubChem CID 83916718) has the molecular formula C12H16FNO and a molecular weight of 209.26 g/mol. Its IUPAC name is (6-fluoro-3-propan-2-yl-2,3-dihydro-1H-indol-2-yl)methanol.

Molecular Properties

Compound Name(6-fluoro-3-propan-2-yl-2,3-dihydro-1H-indol-2-yl)methanol
PubChem CID83916718
Molecular FormulaC12H16FNO
Molecular Weight209.26 g/mol
Exact Mass209.12
IUPAC Name(6-fluoro-3-propan-2-yl-2,3-dihydro-1H-indol-2-yl)methanol
SMILESCC(C)C1c2ccc(F)cc2NC1CO
InChIInChI=1S/C12H16FNO/c1-7(2)12-9-4-3-8(13)5-10(9)14-11(12)6-15/h3-5,7,11-12,14-15H,6H2,1-2H3
InChIKeyGPTWFDDJZNQYIP-UHFFFAOYSA-N
XLogP2.35
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.26
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (6-fluoro-3-propan-2-yl-2,3-dihydro-1H-indol-2-yl)methanol?
The IUPAC name of (6-fluoro-3-propan-2-yl-2,3-dihydro-1H-indol-2-yl)methanol (CID 83916718) is (6-fluoro-3-propan-2-yl-2,3-dihydro-1H-indol-2-yl)methanol.
What is the SMILES notation for (6-fluoro-3-propan-2-yl-2,3-dihydro-1H-indol-2-yl)methanol?
The canonical SMILES for (6-fluoro-3-propan-2-yl-2,3-dihydro-1H-indol-2-yl)methanol is CC(C)C1c2ccc(F)cc2NC1CO.
What is the InChIKey of (6-fluoro-3-propan-2-yl-2,3-dihydro-1H-indol-2-yl)methanol?
The InChIKey is GPTWFDDJZNQYIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO/c1-7(2)12-9-4-3-8(13)5-10(9)14-11(12)6-15/h3-5,7,11-12,14-15H,6H2,1-2H3.
What are the key properties of (6-fluoro-3-propan-2-yl-2,3-dihydro-1H-indol-2-yl)methanol?
(6-fluoro-3-propan-2-yl-2,3-dihydro-1H-indol-2-yl)methanol has a molecular weight of 209.26 g/mol, XLogP of 2.35, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-fluoro-3-propan-2-yl-2,3-dihydro-1H-indol-2-yl)methanol is sourced from PubChem (CID 83916718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).