3-(2-aminoethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-4-amine

C13H20N2 — CID 112709075

IUPAC3-(2-aminoethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-4-amine
SMILESCN(C)c1cccc2c1C(CCN)CC2
InChIInChI=1S/C13H20N2/c1-15(2)12-5-3-4-10-6-7-11(8-9-14)13(10)12/h3-5,11H,6-9,14H2,1-2H3
InChIKeyNNWBEDCVRBAPDH-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.13
Rot. Bonds3

About 3-(2-aminoethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-4-amine

3-(2-aminoethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-4-amine (PubChem CID 112709075) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 3-(2-aminoethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-4-amine.

Molecular Properties

Compound Name3-(2-aminoethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-4-amine
PubChem CID112709075
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name3-(2-aminoethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-4-amine
SMILESCN(C)c1cccc2c1C(CCN)CC2
InChIInChI=1S/C13H20N2/c1-15(2)12-5-3-4-10-6-7-11(8-9-14)13(10)12/h3-5,11H,6-9,14H2,1-2H3
InChIKeyNNWBEDCVRBAPDH-UHFFFAOYSA-N
XLogP2.13
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(7-bromo-2,3-dihydro-1H-inden-1-yl)ethanamine
CID 83843148
8-N,8-N-dimethyl-1,2,3,4-tetrahydronaphthalene-1,8-diamine
CID 112708810
2-(8-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 83829383
2-(7-pyrrolidin-1-yl-2,3-dihydro-1H-inden-1-yl)ethanamine
CID 105422248
7-(dimethylamino)-2,3-dihydro-1H-indene-1-carboxylic acid
CID 112709090
3-(2-aminoethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-5-amine
CID 105456837
3-(aminomethyl)-N-methyl-2,3-dihydro-1H-inden-4-amine
CID 112708686
2-(5,8-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 82076847
2-(1,4,5,6-tetrahydrocyclopenta[b]pyrrol-4-yl)ethanamine
CID 82417410
7-fluoro-2,3-dihydro-1H-inden-1-amine
CID 58440160
8-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-ol
CID 83827745
N'-(2,3-dihydro-1H-inden-1-yl)-N'-methylethane-1,2-diamine
CID 62682207

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminoethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-4-amine?
The IUPAC name of 3-(2-aminoethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-4-amine (CID 112709075) is 3-(2-aminoethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-4-amine.
What is the SMILES notation for 3-(2-aminoethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-4-amine?
The canonical SMILES for 3-(2-aminoethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-4-amine is CN(C)c1cccc2c1C(CCN)CC2.
What is the InChIKey of 3-(2-aminoethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-4-amine?
The InChIKey is NNWBEDCVRBAPDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-15(2)12-5-3-4-10-6-7-11(8-9-14)13(10)12/h3-5,11H,6-9,14H2,1-2H3.
What are the key properties of 3-(2-aminoethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-4-amine?
3-(2-aminoethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-4-amine has a molecular weight of 204.32 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminoethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-4-amine is sourced from PubChem (CID 112709075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).