1-[(4-fluoro-2-methyl-1H-indol-5-yl)methyl]cyclopropan-1-ol

C13H14FNO — CID 117312344

IUPAC1-[(4-fluoro-2-methyl-1H-indol-5-yl)methyl]cyclopropan-1-ol
SMILESCc1cc2c(F)c(CC3(O)CC3)ccc2[nH]1
InChIInChI=1S/C13H14FNO/c1-8-6-10-11(15-8)3-2-9(12(10)14)7-13(16)4-5-13/h2-3,6,15-16H,4-5,7H2,1H3
InChIKeyPDLZHAKYSNDKBT-UHFFFAOYSA-N
MW219.26 g/mol
LogP2.68
Rot. Bonds2

About 1-[(4-fluoro-2-methyl-1H-indol-5-yl)methyl]cyclopropan-1-ol

1-[(4-fluoro-2-methyl-1H-indol-5-yl)methyl]cyclopropan-1-ol (PubChem CID 117312344) has the molecular formula C13H14FNO and a molecular weight of 219.26 g/mol. Its IUPAC name is 1-[(4-fluoro-2-methyl-1H-indol-5-yl)methyl]cyclopropan-1-ol.

Molecular Properties

Compound Name1-[(4-fluoro-2-methyl-1H-indol-5-yl)methyl]cyclopropan-1-ol
PubChem CID117312344
Molecular FormulaC13H14FNO
Molecular Weight219.26 g/mol
Exact Mass219.11
IUPAC Name1-[(4-fluoro-2-methyl-1H-indol-5-yl)methyl]cyclopropan-1-ol
SMILESCc1cc2c(F)c(CC3(O)CC3)ccc2[nH]1
InChIInChI=1S/C13H14FNO/c1-8-6-10-11(15-8)3-2-9(12(10)14)7-13(16)4-5-13/h2-3,6,15-16H,4-5,7H2,1H3
InChIKeyPDLZHAKYSNDKBT-UHFFFAOYSA-N
XLogP2.68
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.26
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 1-[(4-fluoro-2-methyl-1H-indol-5-yl)methyl]cyclopropan-1-ol 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

4-fluoro-2-methyl-1H-indol-5-amine
CID 44558426
(4-chloro-2-methyl-1H-indol-5-yl)methanol
CID 84666570
2-fluoro-3-[(1-hydroxycyclopropyl)methyl]-5-methylphenol
CID 117286145
5-(aminomethyl)-2-methyl-1H-indol-4-ol
CID 82599148
1-[(2,3-difluoro-4-methylsulfonylphenyl)methyl]cyclopropan-1-ol
CID 117409977
2-(4-fluoro-2-methyl-1H-indol-5-yl)-2-oxoacetic acid
CID 117315168
1-[(5-chloro-2-fluoro-3-methylphenyl)methyl]cyclopropan-1-ol
CID 117305949
2-[(4-fluoro-2-methyl-1H-indol-5-yl)oxy]acetamide
CID 132970429
ethane;4-fluoro-2-methyl-1H-indole
CID 171088115
1-[(4-bromo-2-methylphenyl)methyl]cyclopropan-1-ol
CID 117354310
1-[(3-chloro-2-fluorophenyl)methyl]cyclopropan-1-ol
CID 117289578
3-(4-chloro-2-methyl-1H-indol-5-yl)propan-1-ol
CID 117321063

Frequently Asked Questions

What is the IUPAC name of 1-[(4-fluoro-2-methyl-1H-indol-5-yl)methyl]cyclopropan-1-ol?
The IUPAC name of 1-[(4-fluoro-2-methyl-1H-indol-5-yl)methyl]cyclopropan-1-ol (CID 117312344) is 1-[(4-fluoro-2-methyl-1H-indol-5-yl)methyl]cyclopropan-1-ol.
What is the SMILES notation for 1-[(4-fluoro-2-methyl-1H-indol-5-yl)methyl]cyclopropan-1-ol?
The canonical SMILES for 1-[(4-fluoro-2-methyl-1H-indol-5-yl)methyl]cyclopropan-1-ol is Cc1cc2c(F)c(CC3(O)CC3)ccc2[nH]1.
What is the InChIKey of 1-[(4-fluoro-2-methyl-1H-indol-5-yl)methyl]cyclopropan-1-ol?
The InChIKey is PDLZHAKYSNDKBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14FNO/c1-8-6-10-11(15-8)3-2-9(12(10)14)7-13(16)4-5-13/h2-3,6,15-16H,4-5,7H2,1H3.
What are the key properties of 1-[(4-fluoro-2-methyl-1H-indol-5-yl)methyl]cyclopropan-1-ol?
1-[(4-fluoro-2-methyl-1H-indol-5-yl)methyl]cyclopropan-1-ol has a molecular weight of 219.26 g/mol, XLogP of 2.68, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-fluoro-2-methyl-1H-indol-5-yl)methyl]cyclopropan-1-ol is sourced from PubChem (CID 117312344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).