N',N'-dimethyl-1-(2-methylphenyl)ethane-1,2-diamine

C11H18N2 — CID 16782044

IUPACN',N'-dimethyl-1-(2-methylphenyl)ethane-1,2-diamine
SMILESCc1ccccc1C(N)CN(C)C
InChIInChI=1S/C11H18N2/c1-9-6-4-5-7-10(9)11(12)8-13(2)3/h4-7,11H,8,12H2,1-3H3
InChIKeyYJNHBORXLCKJPS-UHFFFAOYSA-N
MW178.28 g/mol
LogP1.56
Rot. Bonds3

About N',N'-dimethyl-1-(2-methylphenyl)ethane-1,2-diamine

N',N'-dimethyl-1-(2-methylphenyl)ethane-1,2-diamine (PubChem CID 16782044) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is N',N'-dimethyl-1-(2-methylphenyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-dimethyl-1-(2-methylphenyl)ethane-1,2-diamine
PubChem CID16782044
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC NameN',N'-dimethyl-1-(2-methylphenyl)ethane-1,2-diamine
SMILESCc1ccccc1C(N)CN(C)C
InChIInChI=1S/C11H18N2/c1-9-6-4-5-7-10(9)11(12)8-13(2)3/h4-7,11H,8,12H2,1-3H3
InChIKeyYJNHBORXLCKJPS-UHFFFAOYSA-N
XLogP1.56
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-methyl-N'-(2-methylbutyl)-1-(2-methylphenyl)ethane-1,2-diamine
CID 43295706
N'-methyl-N'-(4-methylpentan-2-yl)-1-(2-methylphenyl)ethane-1,2-diamine
CID 55001596
N'-cycloheptyl-N'-methyl-1-(2-methylphenyl)ethane-1,2-diamine
CID 43614010
2-chloro-N,N-dimethyl-2-(2-methylphenyl)ethanamine
CID 90158415
2-hydrazinyl-N,N-dimethyl-2-(2-methylphenyl)ethanamine
CID 105244597
N'-(1-cyclopropylethyl)-N'-methyl-1-(2-methylphenyl)ethane-1,2-diamine
CID 43569043
N'-[1-(2-fluorophenyl)ethyl]-N'-methyl-1-(2-methylphenyl)ethane-1,2-diamine
CID 62979148
(1S)-4-methyl-1-(2-methylphenyl)pentan-1-amine;hydrochloride
CID 171229467
N'-methyl-1-(2-methylphenyl)-N'-(2-methylsulfonylethyl)ethane-1,2-diamine
CID 79850524
N'-methyl-1-(2-methylphenyl)-N'-(oxan-4-yl)ethane-1,2-diamine
CID 43611052
N'-methyl-1-(2-methylphenyl)-N'-(2-methylpropyl)propane-1,3-diamine
CID 62629061
N'-(4-ethylcyclohexyl)-N'-methyl-1-(2-methylphenyl)ethane-1,2-diamine
CID 61450749

Frequently Asked Questions

What is the IUPAC name of N',N'-dimethyl-1-(2-methylphenyl)ethane-1,2-diamine?
The IUPAC name of N',N'-dimethyl-1-(2-methylphenyl)ethane-1,2-diamine (CID 16782044) is N',N'-dimethyl-1-(2-methylphenyl)ethane-1,2-diamine.
What is the SMILES notation for N',N'-dimethyl-1-(2-methylphenyl)ethane-1,2-diamine?
The canonical SMILES for N',N'-dimethyl-1-(2-methylphenyl)ethane-1,2-diamine is Cc1ccccc1C(N)CN(C)C.
What is the InChIKey of N',N'-dimethyl-1-(2-methylphenyl)ethane-1,2-diamine?
The InChIKey is YJNHBORXLCKJPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2/c1-9-6-4-5-7-10(9)11(12)8-13(2)3/h4-7,11H,8,12H2,1-3H3.
What are the key properties of N',N'-dimethyl-1-(2-methylphenyl)ethane-1,2-diamine?
N',N'-dimethyl-1-(2-methylphenyl)ethane-1,2-diamine has a molecular weight of 178.28 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',N'-dimethyl-1-(2-methylphenyl)ethane-1,2-diamine is sourced from PubChem (CID 16782044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).