(Z)-N',N'-dimethyl-1-(4-methylphenyl)ethene-1,2-diamine

C11H16N2 — CID 149258743

IUPAC(Z)-N',N'-dimethyl-1-(4-methylphenyl)ethene-1,2-diamine
SMILESCc1ccc(/C(N)=C/N(C)C)cc1
InChIInChI=1S/C11H16N2/c1-9-4-6-10(7-5-9)11(12)8-13(2)3/h4-8H,12H2,1-3H3/b11-8-
InChIKeyXOVFSWZCOGCFIF-FLIBITNWSA-N
MW176.26 g/mol
LogP1.81
Rot. Bonds2

About (Z)-N',N'-dimethyl-1-(4-methylphenyl)ethene-1,2-diamine

(Z)-N',N'-dimethyl-1-(4-methylphenyl)ethene-1,2-diamine (PubChem CID 149258743) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is (Z)-N',N'-dimethyl-1-(4-methylphenyl)ethene-1,2-diamine.

Molecular Properties

Compound Name(Z)-N',N'-dimethyl-1-(4-methylphenyl)ethene-1,2-diamine
PubChem CID149258743
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name(Z)-N',N'-dimethyl-1-(4-methylphenyl)ethene-1,2-diamine
SMILESCc1ccc(/C(N)=C/N(C)C)cc1
InChIInChI=1S/C11H16N2/c1-9-4-6-10(7-5-9)11(12)8-13(2)3/h4-8H,12H2,1-3H3/b11-8-
InChIKeyXOVFSWZCOGCFIF-FLIBITNWSA-N
XLogP1.81
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

S-[(Z)-2-amino-2-(4-methylphenyl)ethenyl]thiohydroxylamine;ethane
CID 142052900
(E)-3-(dimethylamino)-2-(4-methylphenyl)prop-2-enoic acid
CID 166747684
3-(dimethylamino)-1,2-bis(4-methylphenyl)prop-2-en-1-one
CID 57169439
(Z)-2-[amino(methyl)amino]-1-(4-bromophenyl)ethenamine
CID 145165497
N-carbamoyl-N,4-dimethylbenzamide
CID 69411182
4-[(Z)-1-amino-2-(N-amino-3,5-dimethylanilino)ethenyl]phenol
CID 167297376
(Z)-3-(dimethylamino)-1-(4-methylphenyl)-2-(4-methylphenyl)sulfanylprop-2-en-1-one
CID 6287102
ethyl (E)-4-(dimethylamino)-3-(4-methylbenzoyl)-2-oxobut-3-enoate
CID 135077752
(Z)-3-amino-3-(4-methylphenyl)-1-phenylprop-2-en-1-one
CID 5376861
ethyl (Z)-3-amino-3-(4-methylphenyl)prop-2-enoate
CID 12021527
(E)-3-amino-3-(4-methylphenyl)-1-phenylprop-2-en-1-one
CID 21160961
(Z)-3-(dimethylamino)-1-(4-methylphenyl)prop-2-ene-1-thione
CID 134891502

Frequently Asked Questions

What is the IUPAC name of (Z)-N',N'-dimethyl-1-(4-methylphenyl)ethene-1,2-diamine?
The IUPAC name of (Z)-N',N'-dimethyl-1-(4-methylphenyl)ethene-1,2-diamine (CID 149258743) is (Z)-N',N'-dimethyl-1-(4-methylphenyl)ethene-1,2-diamine.
What is the SMILES notation for (Z)-N',N'-dimethyl-1-(4-methylphenyl)ethene-1,2-diamine?
The canonical SMILES for (Z)-N',N'-dimethyl-1-(4-methylphenyl)ethene-1,2-diamine is Cc1ccc(/C(N)=C/N(C)C)cc1.
What is the InChIKey of (Z)-N',N'-dimethyl-1-(4-methylphenyl)ethene-1,2-diamine?
The InChIKey is XOVFSWZCOGCFIF-FLIBITNWSA-N. The full InChI is InChI=1S/C11H16N2/c1-9-4-6-10(7-5-9)11(12)8-13(2)3/h4-8H,12H2,1-3H3/b11-8-.
What are the key properties of (Z)-N',N'-dimethyl-1-(4-methylphenyl)ethene-1,2-diamine?
(Z)-N',N'-dimethyl-1-(4-methylphenyl)ethene-1,2-diamine has a molecular weight of 176.26 g/mol, XLogP of 1.81, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N',N'-dimethyl-1-(4-methylphenyl)ethene-1,2-diamine is sourced from PubChem (CID 149258743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).