N-ethyl-1-(4-ethylphenyl)-N'-(2-methylpropyl)-N'-propan-2-ylethane-1,2-diamine

C19H34N2 — CID 63470331

IUPACN-ethyl-1-(4-ethylphenyl)-N'-(2-methylpropyl)-N'-propan-2-ylethane-1,2-diamine
SMILESCCNC(CN(CC(C)C)C(C)C)c1ccc(CC)cc1
InChIInChI=1S/C19H34N2/c1-7-17-9-11-18(12-10-17)19(20-8-2)14-21(16(5)6)13-15(3)4/h9-12,15-16,19-20H,7-8,13-14H2,1-6H3
InChIKeyYLQWBNSDNCGKCL-UHFFFAOYSA-N
MW290.50 g/mol
LogP4.27
Rot. Bonds9

About N-ethyl-1-(4-ethylphenyl)-N'-(2-methylpropyl)-N'-propan-2-ylethane-1,2-diamine

N-ethyl-1-(4-ethylphenyl)-N'-(2-methylpropyl)-N'-propan-2-ylethane-1,2-diamine (PubChem CID 63470331) has the molecular formula C19H34N2 and a molecular weight of 290.50 g/mol. Its IUPAC name is N-ethyl-1-(4-ethylphenyl)-N'-(2-methylpropyl)-N'-propan-2-ylethane-1,2-diamine.

Molecular Properties

Compound NameN-ethyl-1-(4-ethylphenyl)-N'-(2-methylpropyl)-N'-propan-2-ylethane-1,2-diamine
PubChem CID63470331
Molecular FormulaC19H34N2
Molecular Weight290.50 g/mol
Exact Mass290.27
IUPAC NameN-ethyl-1-(4-ethylphenyl)-N'-(2-methylpropyl)-N'-propan-2-ylethane-1,2-diamine
SMILESCCNC(CN(CC(C)C)C(C)C)c1ccc(CC)cc1
InChIInChI=1S/C19H34N2/c1-7-17-9-11-18(12-10-17)19(20-8-2)14-21(16(5)6)13-15(3)4/h9-12,15-16,19-20H,7-8,13-14H2,1-6H3
InChIKeyYLQWBNSDNCGKCL-UHFFFAOYSA-N
XLogP4.27
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.50
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-(cyclopropylmethyl)-N-ethyl-1-(4-ethylphenyl)-N'-propan-2-ylethane-1,2-diamine
CID 63468895
1-(4-methylphenyl)-N'-(2-methylpropyl)-N'-propan-2-yl-N-propylethane-1,2-diamine
CID 63469252
N'-(2-methylpropyl)-1-phenyl-N'-propan-2-yl-N-propylethane-1,2-diamine
CID 63469072
N-ethyl-1-(4-ethylphenyl)-N'-methyl-N'-phenylethane-1,2-diamine
CID 63466547
2-tert-butylsulfonyl-N-ethyl-1-(4-ethylphenyl)ethanamine
CID 64646371
N'-(2-ethoxyethyl)-N,N'-diethyl-1-(4-ethylphenyl)ethane-1,2-diamine
CID 63697022
N-ethyl-1-(4-ethylphenyl)pentan-1-amine
CID 43491414
N-[bis(4-ethylphenyl)methyl]ethanamine
CID 43491437
N-ethyl-1-(4-ethylphenyl)-3-methoxypropan-1-amine
CID 62542901
1-(4-ethylphenyl)-N,5-dimethylhexan-1-amine
CID 83161767
1-(4-butylphenyl)-N-ethyl-4-methylpentan-1-amine
CID 43491199
2-(3,5-difluorophenyl)-N-ethyl-1-(4-ethylphenyl)ethanamine
CID 63416924

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(4-ethylphenyl)-N'-(2-methylpropyl)-N'-propan-2-ylethane-1,2-diamine?
The IUPAC name of N-ethyl-1-(4-ethylphenyl)-N'-(2-methylpropyl)-N'-propan-2-ylethane-1,2-diamine (CID 63470331) is N-ethyl-1-(4-ethylphenyl)-N'-(2-methylpropyl)-N'-propan-2-ylethane-1,2-diamine.
What is the SMILES notation for N-ethyl-1-(4-ethylphenyl)-N'-(2-methylpropyl)-N'-propan-2-ylethane-1,2-diamine?
The canonical SMILES for N-ethyl-1-(4-ethylphenyl)-N'-(2-methylpropyl)-N'-propan-2-ylethane-1,2-diamine is CCNC(CN(CC(C)C)C(C)C)c1ccc(CC)cc1.
What is the InChIKey of N-ethyl-1-(4-ethylphenyl)-N'-(2-methylpropyl)-N'-propan-2-ylethane-1,2-diamine?
The InChIKey is YLQWBNSDNCGKCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N2/c1-7-17-9-11-18(12-10-17)19(20-8-2)14-21(16(5)6)13-15(3)4/h9-12,15-16,19-20H,7-8,13-14H2,1-6H3.
What are the key properties of N-ethyl-1-(4-ethylphenyl)-N'-(2-methylpropyl)-N'-propan-2-ylethane-1,2-diamine?
N-ethyl-1-(4-ethylphenyl)-N'-(2-methylpropyl)-N'-propan-2-ylethane-1,2-diamine has a molecular weight of 290.50 g/mol, XLogP of 4.27, 9 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'-(2-methylpropyl)-N'-propan-2-ylethane-1,2-diamine is sourced from PubChem (CID 63470331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).