N-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)-N'-propan-2-ylpropane-1,3-diamine

C18H32N2O — CID 82940916

IUPACN-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)-N'-propan-2-ylpropane-1,3-diamine
SMILESCCNC(CCN(CCOC)C(C)C)c1ccc(C)cc1
InChIInChI=1S/C18H32N2O/c1-6-19-18(17-9-7-16(4)8-10-17)11-12-20(15(2)3)13-14-21-5/h7-10,15,18-19H,6,11-14H2,1-5H3
InChIKeyLVYZCCRQJPXIGZ-UHFFFAOYSA-N
MW292.47 g/mol
LogP3.39
Rot. Bonds10

About N-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)-N'-propan-2-ylpropane-1,3-diamine

N-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)-N'-propan-2-ylpropane-1,3-diamine (PubChem CID 82940916) has the molecular formula C18H32N2O and a molecular weight of 292.47 g/mol. Its IUPAC name is N-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)-N'-propan-2-ylpropane-1,3-diamine.

Molecular Properties

Compound NameN-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)-N'-propan-2-ylpropane-1,3-diamine
PubChem CID82940916
Molecular FormulaC18H32N2O
Molecular Weight292.47 g/mol
Exact Mass292.25
IUPAC NameN-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)-N'-propan-2-ylpropane-1,3-diamine
SMILESCCNC(CCN(CCOC)C(C)C)c1ccc(C)cc1
InChIInChI=1S/C18H32N2O/c1-6-19-18(17-9-7-16(4)8-10-17)11-12-20(15(2)3)13-14-21-5/h7-10,15,18-19H,6,11-14H2,1-5H3
InChIKeyLVYZCCRQJPXIGZ-UHFFFAOYSA-N
XLogP3.39
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.47
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N'-(2-methoxyethyl)-1-phenyl-N'-propan-2-ylpropane-1,3-diamine
CID 82953260
N-ethyl-N'-(1-methoxypropan-2-yl)-N'-methyl-1-(4-methylphenyl)propane-1,3-diamine
CID 62618250
N'-(2-methoxyethyl)-N-methyl-1-(4-methylphenyl)-N'-propan-2-ylethane-1,2-diamine
CID 82949092
N-ethyl-1-(4-methylphenyl)-3-propan-2-yloxypropan-1-amine
CID 115002189
1-(4-chlorophenyl)-N,N'-diethyl-N'-(1-methoxypropan-2-yl)propane-1,3-diamine
CID 62643465
N'-(2-ethoxyethyl)-N,N'-diethyl-1-(4-methylphenyl)propane-1,3-diamine
CID 63692117
N'-ethyl-N-methyl-1-(4-methylphenyl)-N'-propan-2-ylpropane-1,3-diamine
CID 62619243
N,N'-diethyl-1-(4-methylphenyl)-N'-propylpropane-1,3-diamine
CID 62617865
N',N'-bis(2-methoxyethyl)-N-methyl-1-(4-methylphenyl)propane-1,3-diamine
CID 62618960
3-(ethylamino)-3-(4-methylphenyl)propan-1-ol
CID 64813855
N-ethyl-1-(4-ethylphenyl)-3-methoxypropan-1-amine
CID 62542901
N-ethyl-2-(2-methoxyethylsulfinyl)-1-(4-methylphenyl)ethanamine
CID 64652293

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)-N'-propan-2-ylpropane-1,3-diamine?
The IUPAC name of N-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)-N'-propan-2-ylpropane-1,3-diamine (CID 82940916) is N-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)-N'-propan-2-ylpropane-1,3-diamine.
What is the SMILES notation for N-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)-N'-propan-2-ylpropane-1,3-diamine?
The canonical SMILES for N-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)-N'-propan-2-ylpropane-1,3-diamine is CCNC(CCN(CCOC)C(C)C)c1ccc(C)cc1.
What is the InChIKey of N-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)-N'-propan-2-ylpropane-1,3-diamine?
The InChIKey is LVYZCCRQJPXIGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O/c1-6-19-18(17-9-7-16(4)8-10-17)11-12-20(15(2)3)13-14-21-5/h7-10,15,18-19H,6,11-14H2,1-5H3.
What are the key properties of N-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)-N'-propan-2-ylpropane-1,3-diamine?
N-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)-N'-propan-2-ylpropane-1,3-diamine has a molecular weight of 292.47 g/mol, XLogP of 3.39, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)-N'-propan-2-ylpropane-1,3-diamine is sourced from PubChem (CID 82940916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).