1-[4-(4-chloro-2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine

C16H19ClN2O2 — CID 25066443

IUPAC1-[4-(4-chloro-2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine
SMILESCOc1cc(Cl)ccc1Oc1cc(C)ncc1CN(C)C
InChIInChI=1S/C16H19ClN2O2/c1-11-7-15(12(9-18-11)10-19(2)3)21-14-6-5-13(17)8-16(14)20-4/h5-9H,10H2,1-4H3
InChIKeyYQRYFSQPEXVGIK-UHFFFAOYSA-N
MW306.79 g/mol
LogP3.91
Rot. Bonds5

About 1-[4-(4-chloro-2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine

1-[4-(4-chloro-2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine (PubChem CID 25066443) has the molecular formula C16H19ClN2O2 and a molecular weight of 306.79 g/mol. Its IUPAC name is 1-[4-(4-chloro-2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[4-(4-chloro-2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine
PubChem CID25066443
Molecular FormulaC16H19ClN2O2
Molecular Weight306.79 g/mol
Exact Mass306.11
IUPAC Name1-[4-(4-chloro-2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine
SMILESCOc1cc(Cl)ccc1Oc1cc(C)ncc1CN(C)C
InChIInChI=1S/C16H19ClN2O2/c1-11-7-15(12(9-18-11)10-19(2)3)21-14-6-5-13(17)8-16(14)20-4/h5-9H,10H2,1-4H3
InChIKeyYQRYFSQPEXVGIK-UHFFFAOYSA-N
XLogP3.91
TPSA34.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.79
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[4-(4-chloro-2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine with MolForge

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Related Compounds

2-(4-Chlorophenoxy)-4-methoxynicotinonitrile
CID 1470949
2-(4-Chlorophenoxy)-4-(dimethylamino)-3-pyridinecarbonitrile
CID 1488716
N-methyl(6-methyl-4-(2-phenoxyphenoxy)pyridin-3-yl)methanamine
CID 25022704
1-[4-(4-chloro-2-methylphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine
CID 44449236
1-[4-(4-chloro-2-methylphenoxy)-6-methyl-3-pyridinyl]-N-methylmethanamine
CID 44449239
1-[4-(4-chloro-2-methylphenoxy)-3-pyridinyl]-N,N-dimethylmethanamine
CID 44449267
1-[4-(4-chloro-2-ethylphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine
CID 44449268
1-[4-(4-chloro-2-ethylphenoxy)-6-methyl-3-pyridinyl]-N-methylmethanamine
CID 44449270
1-[4-(4-chloro-2-ethylphenoxy)-3-pyridinyl]-N,N-dimethylmethanamine
CID 44449272
1-[4-(4-chloro-2-methoxyphenoxy)-3-pyridinyl]-N,N-dimethylmethanamine
CID 44449297
1-[4-(4-chloro-2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N-methylmethanamine
CID 44449298
1-[4-(4-chloro-2-methoxyphenoxy)-3-pyridinyl]-N-methylmethanamine
CID 44449332

Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-chloro-2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[4-(4-chloro-2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine (CID 25066443) is 1-[4-(4-chloro-2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[4-(4-chloro-2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[4-(4-chloro-2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine is COc1cc(Cl)ccc1Oc1cc(C)ncc1CN(C)C.
What is the InChIKey of 1-[4-(4-chloro-2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine?
The InChIKey is YQRYFSQPEXVGIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19ClN2O2/c1-11-7-15(12(9-18-11)10-19(2)3)21-14-6-5-13(17)8-16(14)20-4/h5-9H,10H2,1-4H3.
What are the key properties of 1-[4-(4-chloro-2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine?
1-[4-(4-chloro-2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine has a molecular weight of 306.79 g/mol, XLogP of 3.91, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-chloro-2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine is sourced from PubChem (CID 25066443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).