1-N,2-N,2-N-triethyl-2-methyl-1-(4-propylphenyl)propane-1,2-diamine

C19H34N2 — CID 79046664

IUPAC1-N,2-N,2-N-triethyl-2-methyl-1-(4-propylphenyl)propane-1,2-diamine
SMILESCCCc1ccc(C(NCC)C(C)(C)N(CC)CC)cc1
InChIInChI=1S/C19H34N2/c1-7-11-16-12-14-17(15-13-16)18(20-8-2)19(5,6)21(9-3)10-4/h12-15,18,20H,7-11H2,1-6H3
InChIKeyHJWZMIGDXSICDV-UHFFFAOYSA-N
MW290.50 g/mol
LogP4.41
Rot. Bonds9

About 1-N,2-N,2-N-triethyl-2-methyl-1-(4-propylphenyl)propane-1,2-diamine

1-N,2-N,2-N-triethyl-2-methyl-1-(4-propylphenyl)propane-1,2-diamine (PubChem CID 79046664) has the molecular formula C19H34N2 and a molecular weight of 290.50 g/mol. Its IUPAC name is 1-N,2-N,2-N-triethyl-2-methyl-1-(4-propylphenyl)propane-1,2-diamine.

Molecular Properties

Compound Name1-N,2-N,2-N-triethyl-2-methyl-1-(4-propylphenyl)propane-1,2-diamine
PubChem CID79046664
Molecular FormulaC19H34N2
Molecular Weight290.50 g/mol
Exact Mass290.27
IUPAC Name1-N,2-N,2-N-triethyl-2-methyl-1-(4-propylphenyl)propane-1,2-diamine
SMILESCCCc1ccc(C(NCC)C(C)(C)N(CC)CC)cc1
InChIInChI=1S/C19H34N2/c1-7-11-16-12-14-17(15-13-16)18(20-8-2)19(5,6)21(9-3)10-4/h12-15,18,20H,7-11H2,1-6H3
InChIKeyHJWZMIGDXSICDV-UHFFFAOYSA-N
XLogP4.41
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 ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,2-N,2-N,2-tetramethyl-1-(4-propylphenyl)propane-1,2-diamine
CID 79053289
2-N,2-N-diethyl-1-N,2-dimethyl-1-(3-propylphenyl)propane-1,2-diamine
CID 116544650
[2-methyl-2-methylsulfonyl-1-(4-propylphenyl)propyl]hydrazine
CID 105303910
1-(4-chlorophenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine
CID 79056752
1-N,2-N,2-N-triethyl-1-(furan-2-yl)-2-methylpropane-1,2-diamine
CID 79055999
2-N,2-N-diethyl-1-N,2-dimethyl-1-phenylpropane-1,2-diamine
CID 79056403
1-(4-butylphenyl)-N-ethyl-2,2,3,3-tetrafluoropropan-1-amine
CID 79659815
2-ethoxy-2-methyl-N-propyl-1-(4-propylphenyl)propan-1-amine
CID 116727223
1-N,2-N,2-N,2-tetraethyl-1-(4-methylphenyl)butane-1,2-diamine
CID 79060138
2-methyl-1-(4-propylphenyl)propane-1,2-diol
CID 103449002
2-N,2-N,2-trimethyl-1-(4-propylphenyl)propane-1,2-diamine
CID 79054269
1-(4-ethoxyphenyl)-2-N,2-N-diethyl-1-N,2-dimethylpropane-1,2-diamine
CID 79052774

Frequently Asked Questions

What is the IUPAC name of 1-N,2-N,2-N-triethyl-2-methyl-1-(4-propylphenyl)propane-1,2-diamine?
The IUPAC name of 1-N,2-N,2-N-triethyl-2-methyl-1-(4-propylphenyl)propane-1,2-diamine (CID 79046664) is 1-N,2-N,2-N-triethyl-2-methyl-1-(4-propylphenyl)propane-1,2-diamine.
What is the SMILES notation for 1-N,2-N,2-N-triethyl-2-methyl-1-(4-propylphenyl)propane-1,2-diamine?
The canonical SMILES for 1-N,2-N,2-N-triethyl-2-methyl-1-(4-propylphenyl)propane-1,2-diamine is CCCc1ccc(C(NCC)C(C)(C)N(CC)CC)cc1.
What is the InChIKey of 1-N,2-N,2-N-triethyl-2-methyl-1-(4-propylphenyl)propane-1,2-diamine?
The InChIKey is HJWZMIGDXSICDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N2/c1-7-11-16-12-14-17(15-13-16)18(20-8-2)19(5,6)21(9-3)10-4/h12-15,18,20H,7-11H2,1-6H3.
What are the key properties of 1-N,2-N,2-N-triethyl-2-methyl-1-(4-propylphenyl)propane-1,2-diamine?
1-N,2-N,2-N-triethyl-2-methyl-1-(4-propylphenyl)propane-1,2-diamine has a molecular weight of 290.50 g/mol, XLogP of 4.41, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,2-N,2-N-triethyl-2-methyl-1-(4-propylphenyl)propane-1,2-diamine is sourced from PubChem (CID 79046664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).