N'-(2,3-dihydro-1H-inden-1-yl)-N'-methylethane-1,2-diamine

C12H18N2 — CID 62682207

IUPACN'-(2,3-dihydro-1H-inden-1-yl)-N'-methylethane-1,2-diamine
SMILESCN(CCN)C1CCc2ccccc21
InChIInChI=1S/C12H18N2/c1-14(9-8-13)12-7-6-10-4-2-3-5-11(10)12/h2-5,12H,6-9,13H2,1H3
InChIKeySXNJORVZSXWHPV-UHFFFAOYSA-N
MW190.29 g/mol
LogP1.56
Rot. Bonds3

About N'-(2,3-dihydro-1H-inden-1-yl)-N'-methylethane-1,2-diamine

N'-(2,3-dihydro-1H-inden-1-yl)-N'-methylethane-1,2-diamine (PubChem CID 62682207) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is N'-(2,3-dihydro-1H-inden-1-yl)-N'-methylethane-1,2-diamine.

Molecular Properties

Compound NameN'-(2,3-dihydro-1H-inden-1-yl)-N'-methylethane-1,2-diamine
PubChem CID62682207
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC NameN'-(2,3-dihydro-1H-inden-1-yl)-N'-methylethane-1,2-diamine
SMILESCN(CCN)C1CCc2ccccc21
InChIInChI=1S/C12H18N2/c1-14(9-8-13)12-7-6-10-4-2-3-5-11(10)12/h2-5,12H,6-9,13H2,1H3
InChIKeySXNJORVZSXWHPV-UHFFFAOYSA-N
XLogP1.56
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N'-(2,3-dihydro-1H-inden-1-yl)-N'-methylethane-1,2-diamine?
The IUPAC name of N'-(2,3-dihydro-1H-inden-1-yl)-N'-methylethane-1,2-diamine (CID 62682207) is N'-(2,3-dihydro-1H-inden-1-yl)-N'-methylethane-1,2-diamine.
What is the SMILES notation for N'-(2,3-dihydro-1H-inden-1-yl)-N'-methylethane-1,2-diamine?
The canonical SMILES for N'-(2,3-dihydro-1H-inden-1-yl)-N'-methylethane-1,2-diamine is CN(CCN)C1CCc2ccccc21.
What is the InChIKey of N'-(2,3-dihydro-1H-inden-1-yl)-N'-methylethane-1,2-diamine?
The InChIKey is SXNJORVZSXWHPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-14(9-8-13)12-7-6-10-4-2-3-5-11(10)12/h2-5,12H,6-9,13H2,1H3.
What are the key properties of N'-(2,3-dihydro-1H-inden-1-yl)-N'-methylethane-1,2-diamine?
N'-(2,3-dihydro-1H-inden-1-yl)-N'-methylethane-1,2-diamine has a molecular weight of 190.29 g/mol, XLogP of 1.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,3-dihydro-1H-inden-1-yl)-N'-methylethane-1,2-diamine is sourced from PubChem (CID 62682207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).