N,N-dimethyl-4-[(2-methyl-1-phenylprop-1-enyl)iminomethyl]aniline

C19H22N2 — CID 102364701

IUPACN,N-dimethyl-4-[(2-methyl-1-phenylprop-1-enyl)iminomethyl]aniline
SMILESCC(C)=C(/N=C/c1ccc(N(C)C)cc1)c1ccccc1
InChIInChI=1S/C19H22N2/c1-15(2)19(17-8-6-5-7-9-17)20-14-16-10-12-18(13-11-16)21(3)4/h5-14H,1-4H3/b20-14+
InChIKeyXOVROTZZLXWTQW-XSFVSMFZSA-N
MW278.40 g/mol
LogP4.62
Rot. Bonds4

About N,N-dimethyl-4-[(2-methyl-1-phenylprop-1-enyl)iminomethyl]aniline

N,N-dimethyl-4-[(2-methyl-1-phenylprop-1-enyl)iminomethyl]aniline (PubChem CID 102364701) has the molecular formula C19H22N2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N,N-dimethyl-4-[(2-methyl-1-phenylprop-1-enyl)iminomethyl]aniline.

Molecular Properties

Compound NameN,N-dimethyl-4-[(2-methyl-1-phenylprop-1-enyl)iminomethyl]aniline
PubChem CID102364701
Molecular FormulaC19H22N2
Molecular Weight278.40 g/mol
Exact Mass278.18
IUPAC NameN,N-dimethyl-4-[(2-methyl-1-phenylprop-1-enyl)iminomethyl]aniline
SMILESCC(C)=C(/N=C/c1ccc(N(C)C)cc1)c1ccccc1
InChIInChI=1S/C19H22N2/c1-15(2)19(17-8-6-5-7-9-17)20-14-16-10-12-18(13-11-16)21(3)4/h5-14H,1-4H3/b20-14+
InChIKeyXOVROTZZLXWTQW-XSFVSMFZSA-N
XLogP4.62
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2-[(Z)-[(E)-[4-(dimethylamino)phenyl]methylidenehydrazinylidene]methyl]phenol
CID 135478785
N,N-dimethyl-4-[(Z)-3-phenylbut-2-en-2-yl]aniline
CID 21335817
4-[2,2-bis[4-(dimethylamino)phenyl]-1-phenylethenyl]benzaldehyde
CID 102222128
[4-[(E)-2-[4-(dimethylamino)phenyl]ethenyl]phenyl]-phenylmethanone
CID 132506208
N,N-dimethyl-4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]aniline
CID 132506209
CID 102282703
CID 102282703
N,N-dimethyl-4-[(E)-1-phenylprop-1-enyl]aniline
CID 5382979
1-[3-[[4-(dimethylamino)phenyl]methylideneamino]phenyl]ethanone
CID 831103
1,5-bis[4-(dimethylamino)phenyl]-2,4-diphenylpenta-1,4-dien-3-one
CID 66673921
4-[[8-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-1-yl]iminomethyl]-N,N-dimethylaniline
CID 172965274
2-[(E)-[4-(dimethylamino)phenyl]methylideneamino]oxy-N-methyl-N-phenylacetamide
CID 6892641
[4-amino-3-[[4-(dimethylamino)phenyl]methylideneamino]phenyl]-phenylmethanone
CID 139072228

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[(2-methyl-1-phenylprop-1-enyl)iminomethyl]aniline?
The IUPAC name of N,N-dimethyl-4-[(2-methyl-1-phenylprop-1-enyl)iminomethyl]aniline (CID 102364701) is N,N-dimethyl-4-[(2-methyl-1-phenylprop-1-enyl)iminomethyl]aniline.
What is the SMILES notation for N,N-dimethyl-4-[(2-methyl-1-phenylprop-1-enyl)iminomethyl]aniline?
The canonical SMILES for N,N-dimethyl-4-[(2-methyl-1-phenylprop-1-enyl)iminomethyl]aniline is CC(C)=C(/N=C/c1ccc(N(C)C)cc1)c1ccccc1.
What is the InChIKey of N,N-dimethyl-4-[(2-methyl-1-phenylprop-1-enyl)iminomethyl]aniline?
The InChIKey is XOVROTZZLXWTQW-XSFVSMFZSA-N. The full InChI is InChI=1S/C19H22N2/c1-15(2)19(17-8-6-5-7-9-17)20-14-16-10-12-18(13-11-16)21(3)4/h5-14H,1-4H3/b20-14+.
What are the key properties of N,N-dimethyl-4-[(2-methyl-1-phenylprop-1-enyl)iminomethyl]aniline?
N,N-dimethyl-4-[(2-methyl-1-phenylprop-1-enyl)iminomethyl]aniline has a molecular weight of 278.40 g/mol, XLogP of 4.62, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[(2-methyl-1-phenylprop-1-enyl)iminomethyl]aniline is sourced from PubChem (CID 102364701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).