2-N',2-N'-diethyl-1-(2-methoxyphenyl)propane-2,2-diamine

C14H24N2O — CID 84752665

IUPAC2-N',2-N'-diethyl-1-(2-methoxyphenyl)propane-2,2-diamine
SMILESCCN(CC)C(C)(N)Cc1ccccc1OC
InChIInChI=1S/C14H24N2O/c1-5-16(6-2)14(3,15)11-12-9-7-8-10-13(12)17-4/h7-10H,5-6,11,15H2,1-4H3
InChIKeyRJFHYHQNARSCEC-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.25
Rot. Bonds6

About 2-N',2-N'-diethyl-1-(2-methoxyphenyl)propane-2,2-diamine

2-N',2-N'-diethyl-1-(2-methoxyphenyl)propane-2,2-diamine (PubChem CID 84752665) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 2-N',2-N'-diethyl-1-(2-methoxyphenyl)propane-2,2-diamine.

Molecular Properties

Compound Name2-N',2-N'-diethyl-1-(2-methoxyphenyl)propane-2,2-diamine
PubChem CID84752665
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name2-N',2-N'-diethyl-1-(2-methoxyphenyl)propane-2,2-diamine
SMILESCCN(CC)C(C)(N)Cc1ccccc1OC
InChIInChI=1S/C14H24N2O/c1-5-16(6-2)14(3,15)11-12-9-7-8-10-13(12)17-4/h7-10H,5-6,11,15H2,1-4H3
InChIKeyRJFHYHQNARSCEC-UHFFFAOYSA-N
XLogP2.25
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-N-(cyclobutylmethyl)-2-N-ethyl-3-(2-methoxyphenyl)-2-methylpropane-1,2-diamine
CID 107397731
2-N-ethyl-2-N-[(2-fluoro-3-methoxyphenyl)methyl]-2-methylpropane-1,2-diamine
CID 113453505
1-[2-(chloromethyl)-2-ethylbutyl]-2-methoxybenzene
CID 66036060
2-N-ethyl-2-N-[(2-fluoro-3-methoxyphenyl)methyl]-2-methylbutane-1,2-diamine
CID 104791386
2-[(2-methoxyphenyl)methyl]-2-methylbutanenitrile
CID 65376186
N-ethyl-3-(2-methoxyphenyl)-2,2-dimethylpropan-1-amine
CID 62724934
2-amino-2-bromo-3-(2-methoxyphenyl)propanoic acid
CID 164851883
N-ethyl-4-(2-methoxyphenyl)-3,3-dimethylbutan-1-amine
CID 81021747
ethyl 4-(2-methoxyphenyl)-3-methyl-3-(methylamino)butanoate
CID 65237014
4-(2-methoxyphenyl)-3-methyl-3-(methylamino)butanamide
CID 65236981
2-[(2-methoxyphenyl)methyl]-2-methyl-N-propylpentan-1-amine
CID 62724215
2-N-[1-(2-methoxyphenyl)propan-2-yl]-2-N,3,3-trimethylbutane-1,2-diamine
CID 65483502

Frequently Asked Questions

What is the IUPAC name of 2-N',2-N'-diethyl-1-(2-methoxyphenyl)propane-2,2-diamine?
The IUPAC name of 2-N',2-N'-diethyl-1-(2-methoxyphenyl)propane-2,2-diamine (CID 84752665) is 2-N',2-N'-diethyl-1-(2-methoxyphenyl)propane-2,2-diamine.
What is the SMILES notation for 2-N',2-N'-diethyl-1-(2-methoxyphenyl)propane-2,2-diamine?
The canonical SMILES for 2-N',2-N'-diethyl-1-(2-methoxyphenyl)propane-2,2-diamine is CCN(CC)C(C)(N)Cc1ccccc1OC.
What is the InChIKey of 2-N',2-N'-diethyl-1-(2-methoxyphenyl)propane-2,2-diamine?
The InChIKey is RJFHYHQNARSCEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-5-16(6-2)14(3,15)11-12-9-7-8-10-13(12)17-4/h7-10H,5-6,11,15H2,1-4H3.
What are the key properties of 2-N',2-N'-diethyl-1-(2-methoxyphenyl)propane-2,2-diamine?
2-N',2-N'-diethyl-1-(2-methoxyphenyl)propane-2,2-diamine has a molecular weight of 236.36 g/mol, XLogP of 2.25, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N',2-N'-diethyl-1-(2-methoxyphenyl)propane-2,2-diamine is sourced from PubChem (CID 84752665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).