1-(3,5-dichloro-2-pyridinyl)-1-(2,5-dimethoxyphenyl)-N-methylmethanamine

C15H16Cl2N2O2 — CID 79783522

IUPAC1-(3,5-dichloro-2-pyridinyl)-1-(2,5-dimethoxyphenyl)-N-methylmethanamine
SMILESCNC(c1cc(OC)ccc1OC)c1ncc(Cl)cc1Cl
InChIInChI=1S/C15H16Cl2N2O2/c1-18-14(15-12(17)6-9(16)8-19-15)11-7-10(20-2)4-5-13(11)21-3/h4-8,14,18H,1-3H3
InChIKeyDNTDZQFZPALBFW-UHFFFAOYSA-N
MW327.21 g/mol
LogP3.71
Rot. Bonds5

About 1-(3,5-dichloro-2-pyridinyl)-1-(2,5-dimethoxyphenyl)-N-methylmethanamine

1-(3,5-dichloro-2-pyridinyl)-1-(2,5-dimethoxyphenyl)-N-methylmethanamine (PubChem CID 79783522) has the molecular formula C15H16Cl2N2O2 and a molecular weight of 327.21 g/mol. Its IUPAC name is 1-(3,5-dichloro-2-pyridinyl)-1-(2,5-dimethoxyphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3,5-dichloro-2-pyridinyl)-1-(2,5-dimethoxyphenyl)-N-methylmethanamine
PubChem CID79783522
Molecular FormulaC15H16Cl2N2O2
Molecular Weight327.21 g/mol
Exact Mass326.06
IUPAC Name1-(3,5-dichloro-2-pyridinyl)-1-(2,5-dimethoxyphenyl)-N-methylmethanamine
SMILESCNC(c1cc(OC)ccc1OC)c1ncc(Cl)cc1Cl
InChIInChI=1S/C15H16Cl2N2O2/c1-18-14(15-12(17)6-9(16)8-19-15)11-7-10(20-2)4-5-13(11)21-3/h4-8,14,18H,1-3H3
InChIKeyDNTDZQFZPALBFW-UHFFFAOYSA-N
XLogP3.71
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.21
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[(3,5-dichloro-2-pyridinyl)-(2,5-dimethoxyphenyl)methyl]hydrazine
CID 105248774
[(3,5-dichloro-2-pyridinyl)-(2,4-dimethoxyphenyl)methyl]hydrazine
CID 105248853
1-(2,5-dimethoxyphenyl)-N-methyl-1-pyrimidin-5-ylmethanamine
CID 115827566
1-(5-chloro-2-methoxyphenyl)-1-(4-methoxyphenyl)-N-methylmethanamine
CID 43481650
1-(2-chloro-4-methoxyphenyl)-1-(2-methoxy-5-methylphenyl)-N-methylmethanamine
CID 62504560
1-(2,5-dimethoxyphenyl)-1-(5-methoxy-3-pyridinyl)-N-methylmethanamine
CID 105026152
1-(2,5-dimethoxyphenyl)-N,N'-dimethylmethanediamine
CID 116954299
1-(3,5-dichloro-2-pyridinyl)-N-methyl-1-(4-propan-2-ylphenyl)methanamine
CID 79780803
1-(5-chloro-2-methoxyphenyl)-1-(2-fluoro-4-methoxyphenyl)-N-methylmethanamine
CID 43561335
1-(3-bromo-2-fluorophenyl)-1-(3,5-dichloro-2-pyridinyl)-N-methylmethanamine
CID 106645889
1-(2,5-dimethoxyphenyl)-N-methyl-1-thiophen-2-ylmethanamine
CID 43481960
1-(3,5-dichloro-2-pyridinyl)-1-(5-fluoro-2-methylphenyl)-N-methylmethanamine
CID 79780074

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dichloro-2-pyridinyl)-1-(2,5-dimethoxyphenyl)-N-methylmethanamine?
The IUPAC name of 1-(3,5-dichloro-2-pyridinyl)-1-(2,5-dimethoxyphenyl)-N-methylmethanamine (CID 79783522) is 1-(3,5-dichloro-2-pyridinyl)-1-(2,5-dimethoxyphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(3,5-dichloro-2-pyridinyl)-1-(2,5-dimethoxyphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(3,5-dichloro-2-pyridinyl)-1-(2,5-dimethoxyphenyl)-N-methylmethanamine is CNC(c1cc(OC)ccc1OC)c1ncc(Cl)cc1Cl.
What is the InChIKey of 1-(3,5-dichloro-2-pyridinyl)-1-(2,5-dimethoxyphenyl)-N-methylmethanamine?
The InChIKey is DNTDZQFZPALBFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16Cl2N2O2/c1-18-14(15-12(17)6-9(16)8-19-15)11-7-10(20-2)4-5-13(11)21-3/h4-8,14,18H,1-3H3.
What are the key properties of 1-(3,5-dichloro-2-pyridinyl)-1-(2,5-dimethoxyphenyl)-N-methylmethanamine?
1-(3,5-dichloro-2-pyridinyl)-1-(2,5-dimethoxyphenyl)-N-methylmethanamine has a molecular weight of 327.21 g/mol, XLogP of 3.71, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dichloro-2-pyridinyl)-1-(2,5-dimethoxyphenyl)-N-methylmethanamine is sourced from PubChem (CID 79783522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).