2-(4-fluoro-1-methylindol-2-yl)propan-1-ol

C12H14FNO — CID 117120428

IUPAC2-(4-fluoro-1-methylindol-2-yl)propan-1-ol
SMILESCC(CO)c1cc2c(F)cccc2n1C
InChIInChI=1S/C12H14FNO/c1-8(7-15)12-6-9-10(13)4-3-5-11(9)14(12)2/h3-6,8,15H,7H2,1-2H3
InChIKeyWZUGTSWUPTUQCN-UHFFFAOYSA-N
MW207.25 g/mol
LogP2.41
Rot. Bonds2

About 2-(4-fluoro-1-methylindol-2-yl)propan-1-ol

2-(4-fluoro-1-methylindol-2-yl)propan-1-ol (PubChem CID 117120428) has the molecular formula C12H14FNO and a molecular weight of 207.25 g/mol. Its IUPAC name is 2-(4-fluoro-1-methylindol-2-yl)propan-1-ol.

Molecular Properties

Compound Name2-(4-fluoro-1-methylindol-2-yl)propan-1-ol
PubChem CID117120428
Molecular FormulaC12H14FNO
Molecular Weight207.25 g/mol
Exact Mass207.11
IUPAC Name2-(4-fluoro-1-methylindol-2-yl)propan-1-ol
SMILESCC(CO)c1cc2c(F)cccc2n1C
InChIInChI=1S/C12H14FNO/c1-8(7-15)12-6-9-10(13)4-3-5-11(9)14(12)2/h3-6,8,15H,7H2,1-2H3
InChIKeyWZUGTSWUPTUQCN-UHFFFAOYSA-N
XLogP2.41
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.25
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(4-fluoro-1-methylindole-2-carbonyl)-methylamino]acetic acid
CID 110835783
2-(4-fluoro-1-methylindol-2-yl)acetaldehyde
CID 117194443
ethyl 4-fluoro-1-methylindole-2-carboxylate
CID 171397337
2-(ethylsulfanylmethyl)-4-fluoro-1-methylindole
CID 117173469
4-bromo-2-(1-fluoroethyl)-1-methylindole
CID 84708729
1,4-dimethyl-2-propan-2-ylindole;oxalic acid
CID 19389733
5-(4-fluoro-1-methylindol-2-yl)-1-methylpyrazole-3-carboxylic acid
CID 115108105
2-[3-fluoro-2-(1-fluoroethyl)phenyl]propan-1-ol
CID 117289376
4-fluoro-2-[(3-fluorophenoxy)methyl]-1-methylindole
CID 117173305
N-(1-amino-2-methylpropan-2-yl)-4-fluoro-1-methylindole-2-carboxamide
CID 110833500
1-(4-fluoro-1-propan-2-ylindol-2-yl)-N-methylmethanamine
CID 117173709
1-fluoro-9-methylcarbazole
CID 139447921

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-1-methylindol-2-yl)propan-1-ol?
The IUPAC name of 2-(4-fluoro-1-methylindol-2-yl)propan-1-ol (CID 117120428) is 2-(4-fluoro-1-methylindol-2-yl)propan-1-ol.
What is the SMILES notation for 2-(4-fluoro-1-methylindol-2-yl)propan-1-ol?
The canonical SMILES for 2-(4-fluoro-1-methylindol-2-yl)propan-1-ol is CC(CO)c1cc2c(F)cccc2n1C.
What is the InChIKey of 2-(4-fluoro-1-methylindol-2-yl)propan-1-ol?
The InChIKey is WZUGTSWUPTUQCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO/c1-8(7-15)12-6-9-10(13)4-3-5-11(9)14(12)2/h3-6,8,15H,7H2,1-2H3.
What are the key properties of 2-(4-fluoro-1-methylindol-2-yl)propan-1-ol?
2-(4-fluoro-1-methylindol-2-yl)propan-1-ol has a molecular weight of 207.25 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoro-1-methylindol-2-yl)propan-1-ol is sourced from PubChem (CID 117120428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).