1-(2,6-dichlorophenyl)-2-N,3-N,3-N,3-tetramethylbutane-2,3-diamine

C14H22Cl2N2 — CID 79052907

IUPAC1-(2,6-dichlorophenyl)-2-N,3-N,3-N,3-tetramethylbutane-2,3-diamine
SMILESCNC(Cc1c(Cl)cccc1Cl)C(C)(C)N(C)C
InChIInChI=1S/C14H22Cl2N2/c1-14(2,18(4)5)13(17-3)9-10-11(15)7-6-8-12(10)16/h6-8,13,17H,9H2,1-5H3
InChIKeyQBTZAASKNZEZDI-UHFFFAOYSA-N
MW289.25 g/mol
LogP3.46
Rot. Bonds5

About 1-(2,6-dichlorophenyl)-2-N,3-N,3-N,3-tetramethylbutane-2,3-diamine

1-(2,6-dichlorophenyl)-2-N,3-N,3-N,3-tetramethylbutane-2,3-diamine (PubChem CID 79052907) has the molecular formula C14H22Cl2N2 and a molecular weight of 289.25 g/mol. Its IUPAC name is 1-(2,6-dichlorophenyl)-2-N,3-N,3-N,3-tetramethylbutane-2,3-diamine.

Molecular Properties

Compound Name1-(2,6-dichlorophenyl)-2-N,3-N,3-N,3-tetramethylbutane-2,3-diamine
PubChem CID79052907
Molecular FormulaC14H22Cl2N2
Molecular Weight289.25 g/mol
Exact Mass288.12
IUPAC Name1-(2,6-dichlorophenyl)-2-N,3-N,3-N,3-tetramethylbutane-2,3-diamine
SMILESCNC(Cc1c(Cl)cccc1Cl)C(C)(C)N(C)C
InChIInChI=1S/C14H22Cl2N2/c1-14(2,18(4)5)13(17-3)9-10-11(15)7-6-8-12(10)16/h6-8,13,17H,9H2,1-5H3
InChIKeyQBTZAASKNZEZDI-UHFFFAOYSA-N
XLogP3.46
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.25
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,6-dichlorophenyl)-2-N,3-N,3-N,3-tetramethylpentane-2,3-diamine
CID 79063654
1-(2,6-dichlorophenyl)-3-ethoxy-N,3-dimethylpentan-2-amine
CID 116758747
1-(furan-2-yl)-2-N,3-N,3-N,3-tetramethylbutane-2,3-diamine
CID 83175258
1-(3-methoxyphenyl)-2-N,3-N,3-N,3-tetramethylbutane-2,3-diamine
CID 79054097
1-(2,6-dichlorophenyl)-N-methyl-3-methylsulfanylpropan-2-amine
CID 62692778
3-(2,6-dichlorophenyl)-N,2-dimethyl-1-phenylpropan-1-amine
CID 104845376
[1-(2,6-dichlorophenyl)-3,3-dimethylpentan-2-yl]hydrazine
CID 105293201
1-(2,3-dichlorophenyl)-3-N,3-N,3-trimethyl-2-N-propylbutane-2,3-diamine
CID 107308776
1-(2,6-dichlorophenyl)-3-(dimethylamino)-3-methylpentan-2-ol
CID 79064295
1-(2,6-difluorophenyl)-2-N-ethyl-3-N,3-N,3-trimethylbutane-2,3-diamine
CID 114932249
1-(2,6-dichlorophenyl)-3-(dimethylamino)-3-ethylpentan-2-ol
CID 79061239
1-(5-chlorofuran-2-yl)-2-(2,6-dichlorophenyl)-N-methylethanamine
CID 106691674

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dichlorophenyl)-2-N,3-N,3-N,3-tetramethylbutane-2,3-diamine?
The IUPAC name of 1-(2,6-dichlorophenyl)-2-N,3-N,3-N,3-tetramethylbutane-2,3-diamine (CID 79052907) is 1-(2,6-dichlorophenyl)-2-N,3-N,3-N,3-tetramethylbutane-2,3-diamine.
What is the SMILES notation for 1-(2,6-dichlorophenyl)-2-N,3-N,3-N,3-tetramethylbutane-2,3-diamine?
The canonical SMILES for 1-(2,6-dichlorophenyl)-2-N,3-N,3-N,3-tetramethylbutane-2,3-diamine is CNC(Cc1c(Cl)cccc1Cl)C(C)(C)N(C)C.
What is the InChIKey of 1-(2,6-dichlorophenyl)-2-N,3-N,3-N,3-tetramethylbutane-2,3-diamine?
The InChIKey is QBTZAASKNZEZDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22Cl2N2/c1-14(2,18(4)5)13(17-3)9-10-11(15)7-6-8-12(10)16/h6-8,13,17H,9H2,1-5H3.
What are the key properties of 1-(2,6-dichlorophenyl)-2-N,3-N,3-N,3-tetramethylbutane-2,3-diamine?
1-(2,6-dichlorophenyl)-2-N,3-N,3-N,3-tetramethylbutane-2,3-diamine has a molecular weight of 289.25 g/mol, XLogP of 3.46, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dichlorophenyl)-2-N,3-N,3-N,3-tetramethylbutane-2,3-diamine is sourced from PubChem (CID 79052907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).