1-[3-chloro-6-[(3-chlorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine

C14H14Cl2N2O — CID 65125729

IUPAC1-[3-chloro-6-[(3-chlorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine
SMILESCNCc1nc(OCc2cccc(Cl)c2)ccc1Cl
InChIInChI=1S/C14H14Cl2N2O/c1-17-8-13-12(16)5-6-14(18-13)19-9-10-3-2-4-11(15)7-10/h2-7,17H,8-9H2,1H3
InChIKeyFYKMNOJFPBQKRO-UHFFFAOYSA-N
MW297.19 g/mol
LogP3.69
Rot. Bonds5

About 1-[3-chloro-6-[(3-chlorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine

1-[3-chloro-6-[(3-chlorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine (PubChem CID 65125729) has the molecular formula C14H14Cl2N2O and a molecular weight of 297.19 g/mol. Its IUPAC name is 1-[3-chloro-6-[(3-chlorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-chloro-6-[(3-chlorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine
PubChem CID65125729
Molecular FormulaC14H14Cl2N2O
Molecular Weight297.19 g/mol
Exact Mass296.05
IUPAC Name1-[3-chloro-6-[(3-chlorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine
SMILESCNCc1nc(OCc2cccc(Cl)c2)ccc1Cl
InChIInChI=1S/C14H14Cl2N2O/c1-17-8-13-12(16)5-6-14(18-13)19-9-10-3-2-4-11(15)7-10/h2-7,17H,8-9H2,1H3
InChIKeyFYKMNOJFPBQKRO-UHFFFAOYSA-N
XLogP3.69
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.19
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-chloro-6-(3-ethylphenoxy)-2-pyridinyl]-N-methylmethanamine
CID 62298099
N-[[3-chloro-6-[(4-chlorophenyl)methoxy]-2-pyridinyl]methyl]ethanamine
CID 65125443
1-[3,5-dichloro-2-[(3-chlorophenyl)methoxy]phenyl]-N-methylmethanamine
CID 63499190
1-[2-[(3-chlorophenyl)methoxy]-1,3-oxazol-4-yl]-N-methylmethanamine
CID 113378069
1-(3-chloro-6-octoxy-2-pyridinyl)-N-methylmethanamine
CID 55194459
1-[4-[(3-chlorophenyl)methoxy]-3,5-dimethylphenyl]-N-methylmethanamine
CID 60879302
5-chloro-2-[(3-chlorophenyl)methoxy]pyridine
CID 66232556
1-[4-[(3-chlorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine
CID 65125148
1-[3-chloro-6-[2-[(2-methylpropan-2-yl)oxy]ethoxy]-2-pyridinyl]-N-methylmethanamine
CID 112589608
1-[3-chloro-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]-N-methylmethanamine
CID 62291643
2-chloro-4-[(3-chlorophenyl)methoxy]-6-methylpyrimidine
CID 65124564
N-[[3-chloro-6-(3-chlorophenoxy)-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 62323575

Frequently Asked Questions

What is the IUPAC name of 1-[3-chloro-6-[(3-chlorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[3-chloro-6-[(3-chlorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine (CID 65125729) is 1-[3-chloro-6-[(3-chlorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-chloro-6-[(3-chlorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[3-chloro-6-[(3-chlorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine is CNCc1nc(OCc2cccc(Cl)c2)ccc1Cl.
What is the InChIKey of 1-[3-chloro-6-[(3-chlorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine?
The InChIKey is FYKMNOJFPBQKRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Cl2N2O/c1-17-8-13-12(16)5-6-14(18-13)19-9-10-3-2-4-11(15)7-10/h2-7,17H,8-9H2,1H3.
What are the key properties of 1-[3-chloro-6-[(3-chlorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine?
1-[3-chloro-6-[(3-chlorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine has a molecular weight of 297.19 g/mol, XLogP of 3.69, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-chloro-6-[(3-chlorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 65125729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).