N-ethyl-2-(2-phenylethenyl)aniline

C16H17N — CID 152532004

IUPACN-ethyl-2-(2-phenylethenyl)aniline
SMILESCCNc1ccccc1C=Cc1ccccc1
InChIInChI=1S/C16H17N/c1-2-17-16-11-7-6-10-15(16)13-12-14-8-4-3-5-9-14/h3-13,17H,2H2,1H3
InChIKeyYJSLMOCOKBNWPR-UHFFFAOYSA-N
MW223.32 g/mol
LogP4.29
Rot. Bonds4

About N-ethyl-2-(2-phenylethenyl)aniline

N-ethyl-2-(2-phenylethenyl)aniline (PubChem CID 152532004) has the molecular formula C16H17N and a molecular weight of 223.32 g/mol. Its IUPAC name is N-ethyl-2-(2-phenylethenyl)aniline.

Molecular Properties

Compound NameN-ethyl-2-(2-phenylethenyl)aniline
PubChem CID152532004
Molecular FormulaC16H17N
Molecular Weight223.32 g/mol
Exact Mass223.14
IUPAC NameN-ethyl-2-(2-phenylethenyl)aniline
SMILESCCNc1ccccc1C=Cc1ccccc1
InChIInChI=1S/C16H17N/c1-2-17-16-11-7-6-10-15(16)13-12-14-8-4-3-5-9-14/h3-13,17H,2H2,1H3
InChIKeyYJSLMOCOKBNWPR-UHFFFAOYSA-N
XLogP4.29
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-2-[(Z)-prop-1-enyl]aniline
CID 145027913
N-[2-[(E)-2-phenylethenyl]phenyl]ethanethioamide
CID 134891293
1-ethyl-2-[(Z)-2-phenylethenyl]benzene
CID 142017215
bis(1,2-bis[(E)-2-phenylethenyl]benzene);sulfane
CID 68618408
1-N,2-N-diethylbenzene-1,2-diamine;hydrochloride
CID 158225673
N-(4-methylphenyl)-2-[(E)-2-[2-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline
CID 67688103
ethyl (2E)-2-chloro-2-[[2-[(E)-2-phenylethenyl]phenyl]hydrazinylidene]acetate
CID 134869594
3-phenylprop-2-enyl 2-(ethylamino)benzoate
CID 174405623
propan-2-yl N-[2-[(E)-2-phenylethenyl]phenyl]carbamate
CID 154705773
2-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol
CID 166436804
N-ethylethanamine;4-(2-phenylethenyl)pyridine
CID 67628430
CID 70569152
CID 70569152

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(2-phenylethenyl)aniline?
The IUPAC name of N-ethyl-2-(2-phenylethenyl)aniline (CID 152532004) is N-ethyl-2-(2-phenylethenyl)aniline.
What is the SMILES notation for N-ethyl-2-(2-phenylethenyl)aniline?
The canonical SMILES for N-ethyl-2-(2-phenylethenyl)aniline is CCNc1ccccc1C=Cc1ccccc1.
What is the InChIKey of N-ethyl-2-(2-phenylethenyl)aniline?
The InChIKey is YJSLMOCOKBNWPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N/c1-2-17-16-11-7-6-10-15(16)13-12-14-8-4-3-5-9-14/h3-13,17H,2H2,1H3.
What are the key properties of N-ethyl-2-(2-phenylethenyl)aniline?
N-ethyl-2-(2-phenylethenyl)aniline has a molecular weight of 223.32 g/mol, XLogP of 4.29, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(2-phenylethenyl)aniline is sourced from PubChem (CID 152532004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).