(Z)-N'-[1-[[4-(2,2-dimethylpropylamino)phenyl]diazenyl]ethenyl]-N,N'-dimethylethene-1,2-diamine

C17H27N5 — CID 142936605

IUPAC(Z)-N'-[1-[[4-(2,2-dimethylpropylamino)phenyl]diazenyl]ethenyl]-N,N'-dimethylethene-1,2-diamine
SMILESC=C(/N=N/c1ccc(NCC(C)(C)C)cc1)N(C)/C=C\NC
InChIInChI=1S/C17H27N5/c1-14(22(6)12-11-18-5)20-21-16-9-7-15(8-10-16)19-13-17(2,3)4/h7-12,18-19H,1,13H2,2-6H3/b12-11-,21-20+
InChIKeyZSYBXYYIVHWULW-BHCBCLADSA-N
MW301.44 g/mol
LogP4.32
Rot. Bonds7

About (Z)-N'-[1-[[4-(2,2-dimethylpropylamino)phenyl]diazenyl]ethenyl]-N,N'-dimethylethene-1,2-diamine

(Z)-N'-[1-[[4-(2,2-dimethylpropylamino)phenyl]diazenyl]ethenyl]-N,N'-dimethylethene-1,2-diamine (PubChem CID 142936605) has the molecular formula C17H27N5 and a molecular weight of 301.44 g/mol. Its IUPAC name is (Z)-N'-[1-[[4-(2,2-dimethylpropylamino)phenyl]diazenyl]ethenyl]-N,N'-dimethylethene-1,2-diamine.

Molecular Properties

Compound Name(Z)-N'-[1-[[4-(2,2-dimethylpropylamino)phenyl]diazenyl]ethenyl]-N,N'-dimethylethene-1,2-diamine
PubChem CID142936605
Molecular FormulaC17H27N5
Molecular Weight301.44 g/mol
Exact Mass301.23
IUPAC Name(Z)-N'-[1-[[4-(2,2-dimethylpropylamino)phenyl]diazenyl]ethenyl]-N,N'-dimethylethene-1,2-diamine
SMILESC=C(/N=N/c1ccc(NCC(C)(C)C)cc1)N(C)/C=C\NC
InChIInChI=1S/C17H27N5/c1-14(22(6)12-11-18-5)20-21-16-9-7-15(8-10-16)19-13-17(2,3)4/h7-12,18-19H,1,13H2,2-6H3/b12-11-,21-20+
InChIKeyZSYBXYYIVHWULW-BHCBCLADSA-N
XLogP4.32
TPSA52.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.44
LogP ≤ 54.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-N'-[1-[[4-(2,2-dimethylpropylamino)phenyl]diazenyl]ethenyl]-N,N'-dimethylethene-1,2-diamine?
The IUPAC name of (Z)-N'-[1-[[4-(2,2-dimethylpropylamino)phenyl]diazenyl]ethenyl]-N,N'-dimethylethene-1,2-diamine (CID 142936605) is (Z)-N'-[1-[[4-(2,2-dimethylpropylamino)phenyl]diazenyl]ethenyl]-N,N'-dimethylethene-1,2-diamine.
What is the SMILES notation for (Z)-N'-[1-[[4-(2,2-dimethylpropylamino)phenyl]diazenyl]ethenyl]-N,N'-dimethylethene-1,2-diamine?
The canonical SMILES for (Z)-N'-[1-[[4-(2,2-dimethylpropylamino)phenyl]diazenyl]ethenyl]-N,N'-dimethylethene-1,2-diamine is C=C(/N=N/c1ccc(NCC(C)(C)C)cc1)N(C)/C=C\NC.
What is the InChIKey of (Z)-N'-[1-[[4-(2,2-dimethylpropylamino)phenyl]diazenyl]ethenyl]-N,N'-dimethylethene-1,2-diamine?
The InChIKey is ZSYBXYYIVHWULW-BHCBCLADSA-N. The full InChI is InChI=1S/C17H27N5/c1-14(22(6)12-11-18-5)20-21-16-9-7-15(8-10-16)19-13-17(2,3)4/h7-12,18-19H,1,13H2,2-6H3/b12-11-,21-20+.
What are the key properties of (Z)-N'-[1-[[4-(2,2-dimethylpropylamino)phenyl]diazenyl]ethenyl]-N,N'-dimethylethene-1,2-diamine?
(Z)-N'-[1-[[4-(2,2-dimethylpropylamino)phenyl]diazenyl]ethenyl]-N,N'-dimethylethene-1,2-diamine has a molecular weight of 301.44 g/mol, XLogP of 4.32, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N'-[1-[[4-(2,2-dimethylpropylamino)phenyl]diazenyl]ethenyl]-N,N'-dimethylethene-1,2-diamine is sourced from PubChem (CID 142936605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).