1-[2-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine

C17H22N2O2 — CID 62291859

IUPAC1-[2-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine
SMILESCNCc1c(C)cc(C)nc1OCc1ccc(OC)cc1
InChIInChI=1S/C17H22N2O2/c1-12-9-13(2)19-17(16(12)10-18-3)21-11-14-5-7-15(20-4)8-6-14/h5-9,18H,10-11H2,1-4H3
InChIKeyIAWSZYVWRKDGIF-UHFFFAOYSA-N
MW286.38 g/mol
LogP3.01
Rot. Bonds6

About 1-[2-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine

1-[2-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine (PubChem CID 62291859) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is 1-[2-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine
PubChem CID62291859
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC Name1-[2-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine
SMILESCNCc1c(C)cc(C)nc1OCc1ccc(OC)cc1
InChIInChI=1S/C17H22N2O2/c1-12-9-13(2)19-17(16(12)10-18-3)21-11-14-5-7-15(20-4)8-6-14/h5-9,18H,10-11H2,1-4H3
InChIKeyIAWSZYVWRKDGIF-UHFFFAOYSA-N
XLogP3.01
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[2-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine (CID 62291859) is 1-[2-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[2-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine is CNCc1c(C)cc(C)nc1OCc1ccc(OC)cc1.
What is the InChIKey of 1-[2-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine?
The InChIKey is IAWSZYVWRKDGIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-12-9-13(2)19-17(16(12)10-18-3)21-11-14-5-7-15(20-4)8-6-14/h5-9,18H,10-11H2,1-4H3.
What are the key properties of 1-[2-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine?
1-[2-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine has a molecular weight of 286.38 g/mol, XLogP of 3.01, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(4-methoxyphenyl)methoxy]-4,6-dimethyl-3-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 62291859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).