2-methyl-1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4,5,6,7-tetrahydroindol-4-amine

C14H20N4O — CID 106421032

IUPAC2-methyl-1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4,5,6,7-tetrahydroindol-4-amine
SMILESCc1noc(CCn2c(C)cc3c2CCCC3N)n1
InChIInChI=1S/C14H20N4O/c1-9-8-11-12(15)4-3-5-13(11)18(9)7-6-14-16-10(2)17-19-14/h8,12H,3-7,15H2,1-2H3
InChIKeyANXSZIDHUUPISV-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.07
Rot. Bonds3

About 2-methyl-1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4,5,6,7-tetrahydroindol-4-amine

2-methyl-1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4,5,6,7-tetrahydroindol-4-amine (PubChem CID 106421032) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-methyl-1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4,5,6,7-tetrahydroindol-4-amine.

Molecular Properties

Compound Name2-methyl-1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4,5,6,7-tetrahydroindol-4-amine
PubChem CID106421032
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name2-methyl-1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4,5,6,7-tetrahydroindol-4-amine
SMILESCc1noc(CCn2c(C)cc3c2CCCC3N)n1
InChIInChI=1S/C14H20N4O/c1-9-8-11-12(15)4-3-5-13(11)18(9)7-6-14-16-10(2)17-19-14/h8,12H,3-7,15H2,1-2H3
InChIKeyANXSZIDHUUPISV-UHFFFAOYSA-N
XLogP2.07
TPSA69.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-methyl-1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4,5,6,7-tetrahydroindol-4-amine with MolForge

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Related Compounds

3-(1-Methylindol-3-yl)-5-(1,2,3,6-tetrahydropyridin-5-yl)-1,2,4-oxadiazole
CID 14810834
2-[3-(1-Methylindol-3-yl)-1,2,4-oxadiazol-5-yl]ethanamine
CID 14810844
N-methyl-2-[3-(1-methylindol-3-yl)-1,2,4-oxadiazol-5-yl]ethanamine
CID 14810846
N,N-dimethyl-2-[3-(1-methylindol-3-yl)-1,2,4-oxadiazol-5-yl]ethanamine
CID 14810848
4-methyl-N-[2-[3-(1-methylindol-3-yl)-1,2,4-oxadiazol-5-yl]ethyl]cyclohexan-1-amine
CID 18987413
N-ethyl-3-(2-methyl-1H-indol-1-yl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]propanamide
CID 46988254
4-methyl-N-[2-[3-(1-methylindol-3-yl)-1,2,4-oxadiazol-5-yl]ethyl]cyclohexan-1-amine;hydrochloride
CID 70687211
3,3-dimethyl-N-[2-[3-(1-methylindol-3-yl)-1,2,4-oxadiazol-5-yl]ethyl]butan-1-amine;hydrochloride
CID 70695573
(1R)-1-cyclohexyl-N-[2-[3-(1-methylindol-3-yl)-1,2,4-oxadiazol-5-yl]ethyl]ethanamine;hydrochloride
CID 70697611
N-benzyl-N-methyl-2-[3-(1-methylindol-3-yl)-1,2,4-oxadiazol-5-yl]ethanamine
CID 18987420
N-methyl-N-[2-[3-(1-methylindol-3-yl)-1,2,4-oxadiazol-5-yl]ethyl]cyclohexanamine
CID 18987429
4-[5-(2-aminoethyl)-1,2,4-oxadiazol-3-yl]-N,N-dimethylaniline
CID 28805541

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4,5,6,7-tetrahydroindol-4-amine?
The IUPAC name of 2-methyl-1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4,5,6,7-tetrahydroindol-4-amine (CID 106421032) is 2-methyl-1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4,5,6,7-tetrahydroindol-4-amine.
What is the SMILES notation for 2-methyl-1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4,5,6,7-tetrahydroindol-4-amine?
The canonical SMILES for 2-methyl-1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4,5,6,7-tetrahydroindol-4-amine is Cc1noc(CCn2c(C)cc3c2CCCC3N)n1.
What is the InChIKey of 2-methyl-1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4,5,6,7-tetrahydroindol-4-amine?
The InChIKey is ANXSZIDHUUPISV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-9-8-11-12(15)4-3-5-13(11)18(9)7-6-14-16-10(2)17-19-14/h8,12H,3-7,15H2,1-2H3.
What are the key properties of 2-methyl-1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4,5,6,7-tetrahydroindol-4-amine?
2-methyl-1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4,5,6,7-tetrahydroindol-4-amine has a molecular weight of 260.34 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4,5,6,7-tetrahydroindol-4-amine is sourced from PubChem (CID 106421032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).