1-(2,4-dimethoxyphenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine

C17H30N2O2 — CID 79046908

IUPAC1-(2,4-dimethoxyphenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine
SMILESCCN(CC)C(C)(C)C(NC)c1ccc(OC)cc1OC
InChIInChI=1S/C17H30N2O2/c1-8-19(9-2)17(3,4)16(18-5)14-11-10-13(20-6)12-15(14)21-7/h10-12,16,18H,8-9H2,1-7H3
InChIKeyLQRFQOIDWHRMCU-UHFFFAOYSA-N
MW294.44 g/mol
LogP3.08
Rot. Bonds8

About 1-(2,4-dimethoxyphenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine

1-(2,4-dimethoxyphenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine (PubChem CID 79046908) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is 1-(2,4-dimethoxyphenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine.

Molecular Properties

Compound Name1-(2,4-dimethoxyphenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine
PubChem CID79046908
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC Name1-(2,4-dimethoxyphenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine
SMILESCCN(CC)C(C)(C)C(NC)c1ccc(OC)cc1OC
InChIInChI=1S/C17H30N2O2/c1-8-19(9-2)17(3,4)16(18-5)14-11-10-13(20-6)12-15(14)21-7/h10-12,16,18H,8-9H2,1-7H3
InChIKeyLQRFQOIDWHRMCU-UHFFFAOYSA-N
XLogP3.08
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2,5-dimethoxyphenyl)-N,N-diethyl-1-hydrazinyl-2-methylpropan-2-amine
CID 105239363
1-N,2-N,2-N-triethyl-1-(4-methoxy-2-methylphenyl)-2-methylpropane-1,2-diamine
CID 79046675
1-(2,5-dimethoxyphenyl)-1-N,2-N,2-N,2-tetramethylpropane-1,2-diamine
CID 79053298
1-(4-ethoxyphenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine
CID 79052774
[1-(2,4-dimethoxyphenyl)-2,2-dimethylpropyl]hydrazine
CID 105203197
1-(2,4-dimethoxyphenyl)-2,2-dimethyl-N-propylbutan-1-amine
CID 62679747
(1S)-1-(2,4-dimethoxyphenyl)-N-methylethanamine
CID 15255377
2-N,2-N-diethyl-1-N,2-dimethyl-1-(4-propan-2-yloxyphenyl)propane-1,2-diamine
CID 79047766
methyl 2-[1-(2,4-dimethoxyphenyl)ethylamino]-2-methylpropanoate
CID 43726039
1-(2,4-dimethoxyphenyl)-2-(dimethylamino)-2-methylbutan-1-ol
CID 79064671
1-(2,4-dimethoxyphenyl)-2-methoxy-2-methyl-N-propylbutan-1-amine
CID 116758376
1-chloro-1-(2,4-dimethoxyphenyl)-N-methylmethanamine
CID 116962062

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethoxyphenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine?
The IUPAC name of 1-(2,4-dimethoxyphenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine (CID 79046908) is 1-(2,4-dimethoxyphenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine.
What is the SMILES notation for 1-(2,4-dimethoxyphenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine?
The canonical SMILES for 1-(2,4-dimethoxyphenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine is CCN(CC)C(C)(C)C(NC)c1ccc(OC)cc1OC.
What is the InChIKey of 1-(2,4-dimethoxyphenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine?
The InChIKey is LQRFQOIDWHRMCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O2/c1-8-19(9-2)17(3,4)16(18-5)14-11-10-13(20-6)12-15(14)21-7/h10-12,16,18H,8-9H2,1-7H3.
What are the key properties of 1-(2,4-dimethoxyphenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine?
1-(2,4-dimethoxyphenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine has a molecular weight of 294.44 g/mol, XLogP of 3.08, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethoxyphenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine is sourced from PubChem (CID 79046908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).