N-methyl-1-(4-methylphenyl)-N-(2-pyridin-4-ylethyl)ethenamine

C17H20N2 — CID 144801993

IUPACN-methyl-1-(4-methylphenyl)-N-(2-pyridin-4-ylethyl)ethenamine
SMILESC=C(c1ccc(C)cc1)N(C)CCc1ccncc1
InChIInChI=1S/C17H20N2/c1-14-4-6-17(7-5-14)15(2)19(3)13-10-16-8-11-18-12-9-16/h4-9,11-12H,2,10,13H2,1,3H3
InChIKeyATAOZSKSFZKOPY-UHFFFAOYSA-N
MW252.36 g/mol
LogP3.54
Rot. Bonds5

About N-methyl-1-(4-methylphenyl)-N-(2-pyridin-4-ylethyl)ethenamine

N-methyl-1-(4-methylphenyl)-N-(2-pyridin-4-ylethyl)ethenamine (PubChem CID 144801993) has the molecular formula C17H20N2 and a molecular weight of 252.36 g/mol. Its IUPAC name is N-methyl-1-(4-methylphenyl)-N-(2-pyridin-4-ylethyl)ethenamine.

Molecular Properties

Compound NameN-methyl-1-(4-methylphenyl)-N-(2-pyridin-4-ylethyl)ethenamine
PubChem CID144801993
Molecular FormulaC17H20N2
Molecular Weight252.36 g/mol
Exact Mass252.16
IUPAC NameN-methyl-1-(4-methylphenyl)-N-(2-pyridin-4-ylethyl)ethenamine
SMILESC=C(c1ccc(C)cc1)N(C)CCc1ccncc1
InChIInChI=1S/C17H20N2/c1-14-4-6-17(7-5-14)15(2)19(3)13-10-16-8-11-18-12-9-16/h4-9,11-12H,2,10,13H2,1,3H3
InChIKeyATAOZSKSFZKOPY-UHFFFAOYSA-N
XLogP3.54
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-methylphenyl)-3-[methyl(2-pyridin-4-ylethyl)amino]propan-1-one
CID 62613135
2-amino-N-methyl-2-(4-methylphenyl)-N-(2-pyridin-4-ylethyl)acetamide;dihydrochloride
CID 120670650
1-N-butyl-1-N,4-N-dimethyl-4-N-(2-pyridin-4-ylethyl)benzene-1,4-dicarboxamide
CID 109048088
1-N-(2,5-dimethylphenyl)-4-N-methyl-4-N-(2-pyridin-4-ylethyl)benzene-1,4-dicarboxamide
CID 109048101
N-methyl-5-(4-methylphenyl)-N-(2-pyridin-4-ylethyl)-1,3,4-oxadiazole-2-carboxamide
CID 110391082
2-chloro-N-methyl-N-(2-pyridin-4-ylethyl)acetamide
CID 60913202
N,2-dimethyl-2-(methylamino)-N-(2-pyridin-4-ylethyl)propanamide
CID 62847427
(2E,4E)-N-methyl-N-(2-pyridin-4-ylethyl)hexa-2,4-dienamide
CID 110461207
N-methyl-3-[methyl(2-pyridin-4-ylethyl)amino]-N-(2-pyridin-4-ylethyl)propanamide
CID 109025999
4-(3-methoxyphenyl)-N-methyl-N-(2-pyridin-4-ylethyl)benzamide
CID 77093047
N-methyl-4-propan-2-yloxy-N-(2-pyridin-4-ylethyl)benzamide
CID 110762446
4-chloro-N-methyl-N-(2-pyridin-4-ylethyl)pyridine-3-carboxamide
CID 81226415

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(4-methylphenyl)-N-(2-pyridin-4-ylethyl)ethenamine?
The IUPAC name of N-methyl-1-(4-methylphenyl)-N-(2-pyridin-4-ylethyl)ethenamine (CID 144801993) is N-methyl-1-(4-methylphenyl)-N-(2-pyridin-4-ylethyl)ethenamine.
What is the SMILES notation for N-methyl-1-(4-methylphenyl)-N-(2-pyridin-4-ylethyl)ethenamine?
The canonical SMILES for N-methyl-1-(4-methylphenyl)-N-(2-pyridin-4-ylethyl)ethenamine is C=C(c1ccc(C)cc1)N(C)CCc1ccncc1.
What is the InChIKey of N-methyl-1-(4-methylphenyl)-N-(2-pyridin-4-ylethyl)ethenamine?
The InChIKey is ATAOZSKSFZKOPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2/c1-14-4-6-17(7-5-14)15(2)19(3)13-10-16-8-11-18-12-9-16/h4-9,11-12H,2,10,13H2,1,3H3.
What are the key properties of N-methyl-1-(4-methylphenyl)-N-(2-pyridin-4-ylethyl)ethenamine?
N-methyl-1-(4-methylphenyl)-N-(2-pyridin-4-ylethyl)ethenamine has a molecular weight of 252.36 g/mol, XLogP of 3.54, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(4-methylphenyl)-N-(2-pyridin-4-ylethyl)ethenamine is sourced from PubChem (CID 144801993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).