4,7-dimethyl-5,6-dihydro-1H-indole

C10H13N — CID 145344243

IUPAC4,7-dimethyl-5,6-dihydro-1H-indole
SMILESCC1=c2cc[nH]c2=C(C)CC1
InChIInChI=1S/C10H13N/c1-7-3-4-8(2)10-9(7)5-6-11-10/h5-6,11H,3-4H2,1-2H3
InChIKeyBDLZFPMYGMXEFL-UHFFFAOYSA-N
MW147.22 g/mol
LogP1.15
Rot. Bonds

About 4,7-dimethyl-5,6-dihydro-1H-indole

4,7-dimethyl-5,6-dihydro-1H-indole (PubChem CID 145344243) has the molecular formula C10H13N and a molecular weight of 147.22 g/mol. Its IUPAC name is 4,7-dimethyl-5,6-dihydro-1H-indole.

Molecular Properties

Compound Name4,7-dimethyl-5,6-dihydro-1H-indole
PubChem CID145344243
Molecular FormulaC10H13N
Molecular Weight147.22 g/mol
Exact Mass147.10
IUPAC Name4,7-dimethyl-5,6-dihydro-1H-indole
SMILESCC1=c2cc[nH]c2=C(C)CC1
InChIInChI=1S/C10H13N/c1-7-3-4-8(2)10-9(7)5-6-11-10/h5-6,11H,3-4H2,1-2H3
InChIKeyBDLZFPMYGMXEFL-UHFFFAOYSA-N
XLogP1.15
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

4,9-dimethyl-7,8-dihydro-1H-cycloocta[b]pyrrole
CID 123416584
7-ethyl-5,6-dihydro-1H-indol-4-amine
CID 129236666
ethane;5-methyl-6,7-dihydro-1H-indole
CID 143140793
2,3-dimethyl-1H-pyrrole;ethane
CID 91612743
2-cycloheptyl-3-methyl-1H-pyrrole
CID 173176921
ethane;bis(4-methyl-1H-pyridin-2-one)
CID 158231683
2-methyl-1H-pyrrol-3-olate
CID 152759460
2,3-diethyl-1,4-dimethylcyclohexa-1,3-diene
CID 142364149
hydron;6-methyl-1H-indole
CID 174894355
7-tert-butyl-1,4,5,6-tetrahydropyrrolo[2,3-b]pyridine
CID 146338933
4-(3-methyl-1H-pyrrol-2-yl)piperidine;pyrimidine
CID 174814204
methanethiol;1-methyl-2,3-dihydronaphthalene
CID 143782367

Frequently Asked Questions

What is the IUPAC name of 4,7-dimethyl-5,6-dihydro-1H-indole?
The IUPAC name of 4,7-dimethyl-5,6-dihydro-1H-indole (CID 145344243) is 4,7-dimethyl-5,6-dihydro-1H-indole.
What is the SMILES notation for 4,7-dimethyl-5,6-dihydro-1H-indole?
The canonical SMILES for 4,7-dimethyl-5,6-dihydro-1H-indole is CC1=c2cc[nH]c2=C(C)CC1.
What is the InChIKey of 4,7-dimethyl-5,6-dihydro-1H-indole?
The InChIKey is BDLZFPMYGMXEFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N/c1-7-3-4-8(2)10-9(7)5-6-11-10/h5-6,11H,3-4H2,1-2H3.
What are the key properties of 4,7-dimethyl-5,6-dihydro-1H-indole?
4,7-dimethyl-5,6-dihydro-1H-indole has a molecular weight of 147.22 g/mol, XLogP of 1.15, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-dimethyl-5,6-dihydro-1H-indole is sourced from PubChem (CID 145344243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).