7-fluoro-4-methyl-5,6-dihydro-1H-indole

C9H10FN — CID 123444746

IUPAC7-fluoro-4-methyl-5,6-dihydro-1H-indole
SMILESCC1=c2cc[nH]c2=C(F)CC1
InChIInChI=1S/C9H10FN/c1-6-2-3-8(10)9-7(6)4-5-11-9/h4-5,11H,2-3H2,1H3
InChIKeyYRDZKHMCAUGRHY-UHFFFAOYSA-N
MW151.18 g/mol
LogP1.06
Rot. Bonds

About 7-fluoro-4-methyl-5,6-dihydro-1H-indole

7-fluoro-4-methyl-5,6-dihydro-1H-indole (PubChem CID 123444746) has the molecular formula C9H10FN and a molecular weight of 151.18 g/mol. Its IUPAC name is 7-fluoro-4-methyl-5,6-dihydro-1H-indole.

Molecular Properties

Compound Name7-fluoro-4-methyl-5,6-dihydro-1H-indole
PubChem CID123444746
Molecular FormulaC9H10FN
Molecular Weight151.18 g/mol
Exact Mass151.08
IUPAC Name7-fluoro-4-methyl-5,6-dihydro-1H-indole
SMILESCC1=c2cc[nH]c2=C(F)CC1
InChIInChI=1S/C9H10FN/c1-6-2-3-8(10)9-7(6)4-5-11-9/h4-5,11H,2-3H2,1H3
InChIKeyYRDZKHMCAUGRHY-UHFFFAOYSA-N
XLogP1.06
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.18
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

5,6-Dihydroindole
CID 57086633
Dihydro 5h cyclopenta[c]pyridine
CID 68168321
7,7a-Dihydroindole
CID 68201405
Cyclopentaquinoline
CID 87329973
5-fluoro-2-methyl-2,4-dihydro-1H-indole
CID 89846202
2-ethylidene-3-(1-fluoropropylidene)-1H-pyrrole
CID 123276003
4-fluoro-5,6-dihydro-1H-indole
CID 123307377
2-ethylidene-3-(1-fluoroethylidene)-1H-pyrrole
CID 123394351
3-(1-fluoroethylidene)-2-propylidene-1H-pyrrole
CID 123451091
5-fluoro-5-methyl-1H-cyclohepta[b]pyrrole
CID 142064678
(2Z,3Z)-3-but-3-en-2-ylidene-2-(1-fluoroethylidene)-1H-pyrrole
CID 144346676
(2Z)-2-(1-fluoro-2-methylprop-2-enylidene)-3-methylidene-1H-pyrrole
CID 145117775

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-4-methyl-5,6-dihydro-1H-indole?
The IUPAC name of 7-fluoro-4-methyl-5,6-dihydro-1H-indole (CID 123444746) is 7-fluoro-4-methyl-5,6-dihydro-1H-indole.
What is the SMILES notation for 7-fluoro-4-methyl-5,6-dihydro-1H-indole?
The canonical SMILES for 7-fluoro-4-methyl-5,6-dihydro-1H-indole is CC1=c2cc[nH]c2=C(F)CC1.
What is the InChIKey of 7-fluoro-4-methyl-5,6-dihydro-1H-indole?
The InChIKey is YRDZKHMCAUGRHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FN/c1-6-2-3-8(10)9-7(6)4-5-11-9/h4-5,11H,2-3H2,1H3.
What are the key properties of 7-fluoro-4-methyl-5,6-dihydro-1H-indole?
7-fluoro-4-methyl-5,6-dihydro-1H-indole has a molecular weight of 151.18 g/mol, XLogP of 1.06, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-4-methyl-5,6-dihydro-1H-indole is sourced from PubChem (CID 123444746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).