N'-ethyl-1-(4-ethylphenyl)-N,N'-dipropylethane-1,2-diamine

C18H32N2 — CID 63467155

IUPACN'-ethyl-1-(4-ethylphenyl)-N,N'-dipropylethane-1,2-diamine
SMILESCCCNC(CN(CC)CCC)c1ccc(CC)cc1
InChIInChI=1S/C18H32N2/c1-5-13-19-18(15-20(8-4)14-6-2)17-11-9-16(7-3)10-12-17/h9-12,18-19H,5-8,13-15H2,1-4H3
InChIKeyJPDQWXVMZUBYRN-UHFFFAOYSA-N
MW276.47 g/mol
LogP4.02
Rot. Bonds10

About N'-ethyl-1-(4-ethylphenyl)-N,N'-dipropylethane-1,2-diamine

N'-ethyl-1-(4-ethylphenyl)-N,N'-dipropylethane-1,2-diamine (PubChem CID 63467155) has the molecular formula C18H32N2 and a molecular weight of 276.47 g/mol. Its IUPAC name is N'-ethyl-1-(4-ethylphenyl)-N,N'-dipropylethane-1,2-diamine.

Molecular Properties

Compound NameN'-ethyl-1-(4-ethylphenyl)-N,N'-dipropylethane-1,2-diamine
PubChem CID63467155
Molecular FormulaC18H32N2
Molecular Weight276.47 g/mol
Exact Mass276.26
IUPAC NameN'-ethyl-1-(4-ethylphenyl)-N,N'-dipropylethane-1,2-diamine
SMILESCCCNC(CN(CC)CCC)c1ccc(CC)cc1
InChIInChI=1S/C18H32N2/c1-5-13-19-18(15-20(8-4)14-6-2)17-11-9-16(7-3)10-12-17/h9-12,18-19H,5-8,13-15H2,1-4H3
InChIKeyJPDQWXVMZUBYRN-UHFFFAOYSA-N
XLogP4.02
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.47
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N',N'-diethyl-1-[4-(2-methylpropyl)phenyl]-N-propylethane-1,2-diamine
CID 63466904
N'-(2-ethoxyethyl)-N,N'-diethyl-1-(4-ethylphenyl)ethane-1,2-diamine
CID 63697022
N',N'-diethyl-N-[1-(4-ethylphenyl)propyl]propane-1,3-diamine
CID 43309958
1-(4-ethylphenyl)-3,3-dimethyl-N-propylbutan-1-amine
CID 43496585
1-(4-ethylphenyl)-N',N'-dipropylethane-1,2-diamine
CID 43094884
N-[1-(4-ethylphenyl)ethyl]propan-1-amine
CID 43185208
N'-(cyclopropylmethyl)-N'-ethyl-1-phenyl-N-propylethane-1,2-diamine
CID 63955974
N-[1-(4-ethylphenyl)-2-propylsulfinylethyl]propan-1-amine
CID 64653205
N-[2-(azepan-1-yl)-1-(4-ethylphenyl)ethyl]propan-1-amine
CID 63466733
N-[1-(4-ethylphenyl)-2-(1H-imidazol-2-yl)ethyl]propan-1-amine
CID 43498005
N-[2-chloro-2-(4-ethylphenyl)ethyl]-N-ethylbutan-1-amine
CID 82214360
N-[1-(4-ethylphenyl)-2-(4-methylpentan-2-yloxy)ethyl]propan-1-amine
CID 63474903

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-1-(4-ethylphenyl)-N,N'-dipropylethane-1,2-diamine?
The IUPAC name of N'-ethyl-1-(4-ethylphenyl)-N,N'-dipropylethane-1,2-diamine (CID 63467155) is N'-ethyl-1-(4-ethylphenyl)-N,N'-dipropylethane-1,2-diamine.
What is the SMILES notation for N'-ethyl-1-(4-ethylphenyl)-N,N'-dipropylethane-1,2-diamine?
The canonical SMILES for N'-ethyl-1-(4-ethylphenyl)-N,N'-dipropylethane-1,2-diamine is CCCNC(CN(CC)CCC)c1ccc(CC)cc1.
What is the InChIKey of N'-ethyl-1-(4-ethylphenyl)-N,N'-dipropylethane-1,2-diamine?
The InChIKey is JPDQWXVMZUBYRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2/c1-5-13-19-18(15-20(8-4)14-6-2)17-11-9-16(7-3)10-12-17/h9-12,18-19H,5-8,13-15H2,1-4H3.
What are the key properties of N'-ethyl-1-(4-ethylphenyl)-N,N'-dipropylethane-1,2-diamine?
N'-ethyl-1-(4-ethylphenyl)-N,N'-dipropylethane-1,2-diamine has a molecular weight of 276.47 g/mol, XLogP of 4.02, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-1-(4-ethylphenyl)-N,N'-dipropylethane-1,2-diamine is sourced from PubChem (CID 63467155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).