N-(dimethylamino)-N-[ethyl(3-phenylprop-2-enyl)amino]aniline

C19H25N3 — CID 150835843

IUPACN-(dimethylamino)-N-[ethyl(3-phenylprop-2-enyl)amino]aniline
SMILESCCN(CC=Cc1ccccc1)N(c1ccccc1)N(C)C
InChIInChI=1S/C19H25N3/c1-4-21(17-11-14-18-12-7-5-8-13-18)22(20(2)3)19-15-9-6-10-16-19/h5-16H,4,17H2,1-3H3
InChIKeyKMYKXHPFRFUQEP-UHFFFAOYSA-N
MW295.43 g/mol
LogP3.92
Rot. Bonds7

About N-(dimethylamino)-N-[ethyl(3-phenylprop-2-enyl)amino]aniline

N-(dimethylamino)-N-[ethyl(3-phenylprop-2-enyl)amino]aniline (PubChem CID 150835843) has the molecular formula C19H25N3 and a molecular weight of 295.43 g/mol. Its IUPAC name is N-(dimethylamino)-N-[ethyl(3-phenylprop-2-enyl)amino]aniline.

Molecular Properties

Compound NameN-(dimethylamino)-N-[ethyl(3-phenylprop-2-enyl)amino]aniline
PubChem CID150835843
Molecular FormulaC19H25N3
Molecular Weight295.43 g/mol
Exact Mass295.20
IUPAC NameN-(dimethylamino)-N-[ethyl(3-phenylprop-2-enyl)amino]aniline
SMILESCCN(CC=Cc1ccccc1)N(c1ccccc1)N(C)C
InChIInChI=1S/C19H25N3/c1-4-21(17-11-14-18-12-7-5-8-13-18)22(20(2)3)19-15-9-6-10-16-19/h5-16H,4,17H2,1-3H3
InChIKeyKMYKXHPFRFUQEP-UHFFFAOYSA-N
XLogP3.92
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-N-(3-phenylprop-2-enyl)aniline;hydrochloride
CID 173290020
N'-ethyl-N,N-dimethyl-N'-(3-phenylprop-2-enyl)ethane-1,2-diamine
CID 2845846
N-methyl-N-[(E)-3-phenylprop-2-enyl]formamide
CID 122392912
1,2-dimethyl-1-[(E)-3-phenylprop-2-enyl]hydrazine
CID 137382786
benzene;but-1-enylbenzene
CID 157481332
N,N-diethyl-4-(6-phenylhexa-1,3,5-trienyl)aniline
CID 173357254
N-tert-butyl-2-methyl-N-(3-phenylprop-2-enyl)propan-2-amine
CID 139724022
N-[(E)-3-(4-tert-butylphenyl)prop-2-enyl]-N-methylaniline
CID 164888002
(Z)-N-benzyl-N-methyl-3-phenylprop-2-en-1-amine;hydrochloride
CID 54603104
2-[methyl-[(E)-3-phenylprop-2-enyl]amino]ethanol
CID 14988338
4-methyl-N,N-bis[(E)-3-phenylprop-2-enyl]aniline
CID 10617075
[(1E)-5-phenylpenta-1,4-dienyl]benzene
CID 91021368

Frequently Asked Questions

What is the IUPAC name of N-(dimethylamino)-N-[ethyl(3-phenylprop-2-enyl)amino]aniline?
The IUPAC name of N-(dimethylamino)-N-[ethyl(3-phenylprop-2-enyl)amino]aniline (CID 150835843) is N-(dimethylamino)-N-[ethyl(3-phenylprop-2-enyl)amino]aniline.
What is the SMILES notation for N-(dimethylamino)-N-[ethyl(3-phenylprop-2-enyl)amino]aniline?
The canonical SMILES for N-(dimethylamino)-N-[ethyl(3-phenylprop-2-enyl)amino]aniline is CCN(CC=Cc1ccccc1)N(c1ccccc1)N(C)C.
What is the InChIKey of N-(dimethylamino)-N-[ethyl(3-phenylprop-2-enyl)amino]aniline?
The InChIKey is KMYKXHPFRFUQEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3/c1-4-21(17-11-14-18-12-7-5-8-13-18)22(20(2)3)19-15-9-6-10-16-19/h5-16H,4,17H2,1-3H3.
What are the key properties of N-(dimethylamino)-N-[ethyl(3-phenylprop-2-enyl)amino]aniline?
N-(dimethylamino)-N-[ethyl(3-phenylprop-2-enyl)amino]aniline has a molecular weight of 295.43 g/mol, XLogP of 3.92, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dimethylamino)-N-[ethyl(3-phenylprop-2-enyl)amino]aniline is sourced from PubChem (CID 150835843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).