1-(5-ethyl-2,3-dihydro-1H-indol-2-yl)-N-methylethanamine

C13H20N2 — CID 83860511

IUPAC1-(5-ethyl-2,3-dihydro-1H-indol-2-yl)-N-methylethanamine
SMILESCCc1ccc2c(c1)CC(C(C)NC)N2
InChIInChI=1S/C13H20N2/c1-4-10-5-6-12-11(7-10)8-13(15-12)9(2)14-3/h5-7,9,13-15H,4,8H2,1-3H3
InChIKeyIABIWSPSTBTMHA-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.19
Rot. Bonds3

About 1-(5-ethyl-2,3-dihydro-1H-indol-2-yl)-N-methylethanamine

1-(5-ethyl-2,3-dihydro-1H-indol-2-yl)-N-methylethanamine (PubChem CID 83860511) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 1-(5-ethyl-2,3-dihydro-1H-indol-2-yl)-N-methylethanamine.

Molecular Properties

Compound Name1-(5-ethyl-2,3-dihydro-1H-indol-2-yl)-N-methylethanamine
PubChem CID83860511
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name1-(5-ethyl-2,3-dihydro-1H-indol-2-yl)-N-methylethanamine
SMILESCCc1ccc2c(c1)CC(C(C)NC)N2
InChIInChI=1S/C13H20N2/c1-4-10-5-6-12-11(7-10)8-13(15-12)9(2)14-3/h5-7,9,13-15H,4,8H2,1-3H3
InChIKeyIABIWSPSTBTMHA-UHFFFAOYSA-N
XLogP2.19
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-ethyl-2-(1-fluoroethyl)-2,3-dihydro-1H-indole
CID 84664966
1-(2,3-dihydro-1H-indol-2-yl)-N-methylethanamine
CID 83860499
5-ethyl-2-methyl-2,3-dihydro-1H-indole
CID 70571795
2-tert-butyl-6-ethyl-1,2,3,4-tetrahydroquinolin-3-ol
CID 165488028
2-cyclopentyl-6-ethyl-1,2,3,4-tetrahydroquinolin-3-ol
CID 165476679
2-(4-tert-butylphenyl)-5-ethyl-2,3-dihydro-1H-indole
CID 5134941
5-fluoro-2-propan-2-yl-2,3-dihydro-1H-indole
CID 82276851
5-ethyl-2-[2-(trifluoromethyl)phenyl]-2,3-dihydro-1H-indole
CID 5136391
6-ethyl-3-propan-2-yl-3,4-dihydro-2H-1,4-benzoxazine
CID 82230354
2-butan-2-yl-2,3-dihydro-1H-indole
CID 70399536
2-(5-nitro-2,3-dihydro-1H-indol-2-yl)propan-1-ol
CID 70828178
1-(5-chloro-2,3-dihydro-1H-indol-2-yl)-N-methylpropan-2-amine
CID 117201101

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethyl-2,3-dihydro-1H-indol-2-yl)-N-methylethanamine?
The IUPAC name of 1-(5-ethyl-2,3-dihydro-1H-indol-2-yl)-N-methylethanamine (CID 83860511) is 1-(5-ethyl-2,3-dihydro-1H-indol-2-yl)-N-methylethanamine.
What is the SMILES notation for 1-(5-ethyl-2,3-dihydro-1H-indol-2-yl)-N-methylethanamine?
The canonical SMILES for 1-(5-ethyl-2,3-dihydro-1H-indol-2-yl)-N-methylethanamine is CCc1ccc2c(c1)CC(C(C)NC)N2.
What is the InChIKey of 1-(5-ethyl-2,3-dihydro-1H-indol-2-yl)-N-methylethanamine?
The InChIKey is IABIWSPSTBTMHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-4-10-5-6-12-11(7-10)8-13(15-12)9(2)14-3/h5-7,9,13-15H,4,8H2,1-3H3.
What are the key properties of 1-(5-ethyl-2,3-dihydro-1H-indol-2-yl)-N-methylethanamine?
1-(5-ethyl-2,3-dihydro-1H-indol-2-yl)-N-methylethanamine has a molecular weight of 204.32 g/mol, XLogP of 2.19, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethyl-2,3-dihydro-1H-indol-2-yl)-N-methylethanamine is sourced from PubChem (CID 83860511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).