N'-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]-N-ethylethane-1,2-diamine

C15H24N2 — CID 115205974

IUPACN'-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]-N-ethylethane-1,2-diamine
SMILESCCNCCNCCc1ccc2c(c1)CCC2
InChIInChI=1S/C15H24N2/c1-2-16-10-11-17-9-8-13-6-7-14-4-3-5-15(14)12-13/h6-7,12,16-17H,2-5,8-11H2,1H3
InChIKeyPCBIBDIAXUAQCA-UHFFFAOYSA-N
MW232.37 g/mol
LogP1.92
Rot. Bonds7

About N'-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]-N-ethylethane-1,2-diamine

N'-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]-N-ethylethane-1,2-diamine (PubChem CID 115205974) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N'-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]-N-ethylethane-1,2-diamine.

Molecular Properties

Compound NameN'-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]-N-ethylethane-1,2-diamine
PubChem CID115205974
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN'-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]-N-ethylethane-1,2-diamine
SMILESCCNCCNCCc1ccc2c(c1)CCC2
InChIInChI=1S/C15H24N2/c1-2-16-10-11-17-9-8-13-6-7-14-4-3-5-15(14)12-13/h6-7,12,16-17H,2-5,8-11H2,1H3
InChIKeyPCBIBDIAXUAQCA-UHFFFAOYSA-N
XLogP1.92
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-2-(1,2,3,4-tetrahydroisoquinolin-6-yl)ethanamine
CID 115104816
N'-(2,3-dihydro-1H-inden-5-yl)-N-ethylethane-1,2-diamine
CID 115205551
methyl 3-[2-(2,3-dihydro-1H-inden-5-yl)ethylamino]propanoate
CID 115232486
N-[2-(ethylamino)ethyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide;hydrochloride
CID 119508424
3-propylbicyclo[4.2.0]octa-1(6),2,4-triene
CID 59134563
6-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]-1,2,3,4-tetrahydronaphthalene
CID 19914431
2-(2,3-dihydro-1-benzothiophen-5-yl)-N-ethylethanamine
CID 168764165
N-(2,3-dihydro-1H-inden-5-ylmethyl)propan-1-amine
CID 43163737
5-(2,3-dihydro-1H-inden-5-yl)-N-ethyl-4-methylpent-3-en-1-amine
CID 79598967
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-(2,3-dihydro-1H-inden-5-yl)ethanamine
CID 115244287
2,2-dimethyl-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanenitrile
CID 115234193
2-methyl-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]propanoic acid
CID 115219521

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]-N-ethylethane-1,2-diamine?
The IUPAC name of N'-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]-N-ethylethane-1,2-diamine (CID 115205974) is N'-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]-N-ethylethane-1,2-diamine.
What is the SMILES notation for N'-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]-N-ethylethane-1,2-diamine?
The canonical SMILES for N'-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]-N-ethylethane-1,2-diamine is CCNCCNCCc1ccc2c(c1)CCC2.
What is the InChIKey of N'-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]-N-ethylethane-1,2-diamine?
The InChIKey is PCBIBDIAXUAQCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-2-16-10-11-17-9-8-13-6-7-14-4-3-5-15(14)12-13/h6-7,12,16-17H,2-5,8-11H2,1H3.
What are the key properties of N'-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]-N-ethylethane-1,2-diamine?
N'-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]-N-ethylethane-1,2-diamine has a molecular weight of 232.37 g/mol, XLogP of 1.92, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2,3-dihydro-1H-inden-5-yl)ethyl]-N-ethylethane-1,2-diamine is sourced from PubChem (CID 115205974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).