4-[(4-methoxy-N-methylanilino)methyl]-N-methylpyridin-2-amine

C15H19N3O — CID 62464462

IUPAC4-[(4-methoxy-N-methylanilino)methyl]-N-methylpyridin-2-amine
SMILESCNc1cc(CN(C)c2ccc(OC)cc2)ccn1
InChIInChI=1S/C15H19N3O/c1-16-15-10-12(8-9-17-15)11-18(2)13-4-6-14(19-3)7-5-13/h4-10H,11H2,1-3H3,(H,16,17)
InChIKeyJZYLOUKUWJFNIU-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.77
Rot. Bonds5

About 4-[(4-methoxy-N-methylanilino)methyl]-N-methylpyridin-2-amine

4-[(4-methoxy-N-methylanilino)methyl]-N-methylpyridin-2-amine (PubChem CID 62464462) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 4-[(4-methoxy-N-methylanilino)methyl]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name4-[(4-methoxy-N-methylanilino)methyl]-N-methylpyridin-2-amine
PubChem CID62464462
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name4-[(4-methoxy-N-methylanilino)methyl]-N-methylpyridin-2-amine
SMILESCNc1cc(CN(C)c2ccc(OC)cc2)ccn1
InChIInChI=1S/C15H19N3O/c1-16-15-10-12(8-9-17-15)11-18(2)13-4-6-14(19-3)7-5-13/h4-10H,11H2,1-3H3,(H,16,17)
InChIKeyJZYLOUKUWJFNIU-UHFFFAOYSA-N
XLogP2.77
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

4-[(4-methoxy-N-methylanilino)methyl]-N-propylpyridin-2-amine
CID 62464640
4-[(N,3-dimethylanilino)methyl]-N-methylpyridin-2-amine
CID 62470893
4-[(4-methoxy-N-methylanilino)methyl]-N-methylaniline
CID 115212693
N-[(2-hydrazinyl-4-pyridinyl)methyl]-3-methoxy-N-methylaniline
CID 62471694
4-[[2-methoxyethyl(methyl)amino]methyl]-N-methylpyridin-2-amine
CID 62466112
6-[(4-methoxy-N-methylanilino)methyl]-N-methylpyridin-2-amine
CID 79243198
5-chloro-6-[(4-methoxy-N-methylanilino)methyl]-N-methylpyridin-2-amine
CID 62891685
4-[[cyclopropyl(methyl)amino]methyl]-N-methylpyridin-2-amine
CID 62472223
4-N-[(4-chlorophenyl)methyl]-2-N,4-N-dimethylpyridine-2,4-diamine
CID 113367580
N-[(4-methoxyphenyl)methyl]-N-methyl-4-(methylaminomethyl)pyridin-2-amine
CID 62294613
4-N-[(4-methoxyphenyl)methyl]-2-N,4-N-dimethylpyrimidine-2,4-diamine
CID 80794760
N-(4-methoxyphenyl)-N-methyl-4-(methylaminomethyl)pyridin-2-amine
CID 62293200

Frequently Asked Questions

What is the IUPAC name of 4-[(4-methoxy-N-methylanilino)methyl]-N-methylpyridin-2-amine?
The IUPAC name of 4-[(4-methoxy-N-methylanilino)methyl]-N-methylpyridin-2-amine (CID 62464462) is 4-[(4-methoxy-N-methylanilino)methyl]-N-methylpyridin-2-amine.
What is the SMILES notation for 4-[(4-methoxy-N-methylanilino)methyl]-N-methylpyridin-2-amine?
The canonical SMILES for 4-[(4-methoxy-N-methylanilino)methyl]-N-methylpyridin-2-amine is CNc1cc(CN(C)c2ccc(OC)cc2)ccn1.
What is the InChIKey of 4-[(4-methoxy-N-methylanilino)methyl]-N-methylpyridin-2-amine?
The InChIKey is JZYLOUKUWJFNIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-16-15-10-12(8-9-17-15)11-18(2)13-4-6-14(19-3)7-5-13/h4-10H,11H2,1-3H3,(H,16,17).
What are the key properties of 4-[(4-methoxy-N-methylanilino)methyl]-N-methylpyridin-2-amine?
4-[(4-methoxy-N-methylanilino)methyl]-N-methylpyridin-2-amine has a molecular weight of 257.34 g/mol, XLogP of 2.77, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-methoxy-N-methylanilino)methyl]-N-methylpyridin-2-amine is sourced from PubChem (CID 62464462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).