N-[(Z)-2-amino-2-(4-cyanophenyl)-1-(4-methylphenyl)ethenyl]formamide

C17H15N3O — CID 146626788

IUPACN-[(Z)-2-amino-2-(4-cyanophenyl)-1-(4-methylphenyl)ethenyl]formamide
SMILESCc1ccc(/C(NC=O)=C(/N)c2ccc(C#N)cc2)cc1
InChIInChI=1S/C17H15N3O/c1-12-2-6-15(7-3-12)17(20-11-21)16(19)14-8-4-13(10-18)5-9-14/h2-9,11H,19H2,1H3,(H,20,21)/b17-16-
InChIKeyIWGYMLNNKSFMMC-MSUUIHNZSA-N
MW277.33 g/mol
LogP2.40
Rot. Bonds4

About N-[(Z)-2-amino-2-(4-cyanophenyl)-1-(4-methylphenyl)ethenyl]formamide

N-[(Z)-2-amino-2-(4-cyanophenyl)-1-(4-methylphenyl)ethenyl]formamide (PubChem CID 146626788) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is N-[(Z)-2-amino-2-(4-cyanophenyl)-1-(4-methylphenyl)ethenyl]formamide.

Molecular Properties

Compound NameN-[(Z)-2-amino-2-(4-cyanophenyl)-1-(4-methylphenyl)ethenyl]formamide
PubChem CID146626788
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC NameN-[(Z)-2-amino-2-(4-cyanophenyl)-1-(4-methylphenyl)ethenyl]formamide
SMILESCc1ccc(/C(NC=O)=C(/N)c2ccc(C#N)cc2)cc1
InChIInChI=1S/C17H15N3O/c1-12-2-6-15(7-3-12)17(20-11-21)16(19)14-8-4-13(10-18)5-9-14/h2-9,11H,19H2,1H3,(H,20,21)/b17-16-
InChIKeyIWGYMLNNKSFMMC-MSUUIHNZSA-N
XLogP2.40
TPSA78.91 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-(4-cyanophenyl)-4-methylbenzenecarboximidamide
CID 12966223
4-[(Z)-1-amino-2-cyanoethenyl]benzonitrile
CID 118357400
4-[2-(4-methylphenyl)sulfinylacetyl]benzonitrile
CID 14380227
N-(1-aminoethylidene)-4-cyanobenzamide
CID 130019001
[2-(4-methylanilino)-2-oxoethyl] 4-cyanobenzoate
CID 2592589
4-cyano-N-(2-iodo-4-methylphenyl)benzamide
CID 53308928
N'-(4-cyanophenyl)sulfonyl-4-methylbenzenesulfonohydrazide
CID 8500681
4-(4-cyanophenyl)-N-methylbenzamide
CID 130318851
N-(2-amino-4-cyanophenyl)-4-methylbenzamide
CID 78965634
4-cyanobenzoyl bromide
CID 22321969
3-(4-cyanophenyl)-4-methylbenzamide
CID 154460991
(Z)-3-iodo-3-(4-methylphenyl)prop-2-enenitrile
CID 167052408

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-2-amino-2-(4-cyanophenyl)-1-(4-methylphenyl)ethenyl]formamide?
The IUPAC name of N-[(Z)-2-amino-2-(4-cyanophenyl)-1-(4-methylphenyl)ethenyl]formamide (CID 146626788) is N-[(Z)-2-amino-2-(4-cyanophenyl)-1-(4-methylphenyl)ethenyl]formamide.
What is the SMILES notation for N-[(Z)-2-amino-2-(4-cyanophenyl)-1-(4-methylphenyl)ethenyl]formamide?
The canonical SMILES for N-[(Z)-2-amino-2-(4-cyanophenyl)-1-(4-methylphenyl)ethenyl]formamide is Cc1ccc(/C(NC=O)=C(/N)c2ccc(C#N)cc2)cc1.
What is the InChIKey of N-[(Z)-2-amino-2-(4-cyanophenyl)-1-(4-methylphenyl)ethenyl]formamide?
The InChIKey is IWGYMLNNKSFMMC-MSUUIHNZSA-N. The full InChI is InChI=1S/C17H15N3O/c1-12-2-6-15(7-3-12)17(20-11-21)16(19)14-8-4-13(10-18)5-9-14/h2-9,11H,19H2,1H3,(H,20,21)/b17-16-.
What are the key properties of N-[(Z)-2-amino-2-(4-cyanophenyl)-1-(4-methylphenyl)ethenyl]formamide?
N-[(Z)-2-amino-2-(4-cyanophenyl)-1-(4-methylphenyl)ethenyl]formamide has a molecular weight of 277.33 g/mol, XLogP of 2.40, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-2-amino-2-(4-cyanophenyl)-1-(4-methylphenyl)ethenyl]formamide is sourced from PubChem (CID 146626788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).