N,N-diethyl-2-[2-[4-[2-(2-methylphenyl)ethenyl]phenyl]ethenyl]aniline

C27H29N — CID 58518822

IUPACN,N-diethyl-2-[2-[4-[2-(2-methylphenyl)ethenyl]phenyl]ethenyl]aniline
SMILESCCN(CC)c1ccccc1C=Cc1ccc(C=Cc2ccccc2C)cc1
InChIInChI=1S/C27H29N/c1-4-28(5-2)27-13-9-8-12-26(27)21-19-24-16-14-23(15-17-24)18-20-25-11-7-6-10-22(25)3/h6-21H,4-5H2,1-3H3
InChIKeySENJOQWUUVJHPL-UHFFFAOYSA-N
MW367.54 g/mol
LogP7.18
Rot. Bonds7

About N,N-diethyl-2-[2-[4-[2-(2-methylphenyl)ethenyl]phenyl]ethenyl]aniline

N,N-diethyl-2-[2-[4-[2-(2-methylphenyl)ethenyl]phenyl]ethenyl]aniline (PubChem CID 58518822) has the molecular formula C27H29N and a molecular weight of 367.54 g/mol. Its IUPAC name is N,N-diethyl-2-[2-[4-[2-(2-methylphenyl)ethenyl]phenyl]ethenyl]aniline.

Molecular Properties

Compound NameN,N-diethyl-2-[2-[4-[2-(2-methylphenyl)ethenyl]phenyl]ethenyl]aniline
PubChem CID58518822
Molecular FormulaC27H29N
Molecular Weight367.54 g/mol
Exact Mass367.23
IUPAC NameN,N-diethyl-2-[2-[4-[2-(2-methylphenyl)ethenyl]phenyl]ethenyl]aniline
SMILESCCN(CC)c1ccccc1C=Cc1ccc(C=Cc2ccccc2C)cc1
InChIInChI=1S/C27H29N/c1-4-28(5-2)27-13-9-8-12-26(27)21-19-24-16-14-23(15-17-24)18-20-25-11-7-6-10-22(25)3/h6-21H,4-5H2,1-3H3
InChIKeySENJOQWUUVJHPL-UHFFFAOYSA-N
XLogP7.18
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.54
LogP ≤ 57.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

4-[(Z)-2-(2-methylphenyl)ethenyl]aniline
CID 58868755
2-methyl-N-[4-[2-[2-[2-[4-(4-methyl-N-(2-methylphenyl)anilino)phenyl]ethenyl]phenyl]ethenyl]phenyl]-N-(4-methylphenyl)aniline
CID 59366113
1-N,4-N-bis(4-methylphenyl)-1-N,4-N-bis[4-[(E)-2-(2-methylphenyl)ethenyl]phenyl]naphthalene-1,4-diamine
CID 67099589
(E)-3-[2-(diethylamino)phenyl]prop-2-enal
CID 87134709
4-[2-[4-[2-(2-methylphenyl)ethenyl]phenyl]ethenyl]benzonitrile
CID 142825891
2-methyl-N-[4-[4-(2-methyl-N-[2-[(E)-2-phenylethenyl]phenyl]anilino)phenyl]phenyl]-N-[2-[(E)-2-phenylethenyl]phenyl]aniline
CID 58876508
1-N,1-N,3-N,3-N-tetraethyl-4-[2-[4-(4-methyl-N-[4-(2-phenylethenyl)phenyl]anilino)phenyl]ethenyl]benzene-1,3-diamine
CID 59989534
2-[(E)-2-anthracen-1-ylethenyl]-N,N-diethylaniline
CID 87767218
2-[2-(diethylamino)phenyl]-N,N-diethylaniline
CID 158417392
N,N-diphenyl-2-[2-[4-(N-phenylanilino)phenyl]ethenyl]aniline
CID 161451306
N,N-diethyl-4-[2-[4-[2-(4-methylphenyl)ethenyl]naphthalen-1-yl]ethenyl]aniline
CID 58518835
2-methyl-4-[(E)-2-(2-methylphenyl)ethenyl]aniline
CID 137498181

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[2-[4-[2-(2-methylphenyl)ethenyl]phenyl]ethenyl]aniline?
The IUPAC name of N,N-diethyl-2-[2-[4-[2-(2-methylphenyl)ethenyl]phenyl]ethenyl]aniline (CID 58518822) is N,N-diethyl-2-[2-[4-[2-(2-methylphenyl)ethenyl]phenyl]ethenyl]aniline.
What is the SMILES notation for N,N-diethyl-2-[2-[4-[2-(2-methylphenyl)ethenyl]phenyl]ethenyl]aniline?
The canonical SMILES for N,N-diethyl-2-[2-[4-[2-(2-methylphenyl)ethenyl]phenyl]ethenyl]aniline is CCN(CC)c1ccccc1C=Cc1ccc(C=Cc2ccccc2C)cc1.
What is the InChIKey of N,N-diethyl-2-[2-[4-[2-(2-methylphenyl)ethenyl]phenyl]ethenyl]aniline?
The InChIKey is SENJOQWUUVJHPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H29N/c1-4-28(5-2)27-13-9-8-12-26(27)21-19-24-16-14-23(15-17-24)18-20-25-11-7-6-10-22(25)3/h6-21H,4-5H2,1-3H3.
What are the key properties of N,N-diethyl-2-[2-[4-[2-(2-methylphenyl)ethenyl]phenyl]ethenyl]aniline?
N,N-diethyl-2-[2-[4-[2-(2-methylphenyl)ethenyl]phenyl]ethenyl]aniline has a molecular weight of 367.54 g/mol, XLogP of 7.18, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[2-[4-[2-(2-methylphenyl)ethenyl]phenyl]ethenyl]aniline is sourced from PubChem (CID 58518822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).