1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine

C19H27N3O2 — CID 169449567

IUPAC1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine
SMILESCOc1c(C)cnc(CN(C)Cc2ncc(C)c(OC)c2C)c1C
InChIInChI=1S/C19H27N3O2/c1-12-8-20-16(14(3)18(12)23-6)10-22(5)11-17-15(4)19(24-7)13(2)9-21-17/h8-9H,10-11H2,1-7H3
InChIKeyOIXTZMQCZMJJEC-UHFFFAOYSA-N
MW329.44 g/mol
LogP3.36
Rot. Bonds6

About 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine

1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine (PubChem CID 169449567) has the molecular formula C19H27N3O2 and a molecular weight of 329.44 g/mol. Its IUPAC name is 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine
PubChem CID169449567
Molecular FormulaC19H27N3O2
Molecular Weight329.44 g/mol
Exact Mass329.21
IUPAC Name1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine
SMILESCOc1c(C)cnc(CN(C)Cc2ncc(C)c(OC)c2C)c1C
InChIInChI=1S/C19H27N3O2/c1-12-8-20-16(14(3)18(12)23-6)10-22(5)11-17-15(4)19(24-7)13(2)9-21-17/h8-9H,10-11H2,1-7H3
InChIKeyOIXTZMQCZMJJEC-UHFFFAOYSA-N
XLogP3.36
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.44
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine?
The IUPAC name of 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine (CID 169449567) is 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine.
What is the SMILES notation for 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine?
The canonical SMILES for 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine is COc1c(C)cnc(CN(C)Cc2ncc(C)c(OC)c2C)c1C.
What is the InChIKey of 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine?
The InChIKey is OIXTZMQCZMJJEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O2/c1-12-8-20-16(14(3)18(12)23-6)10-22(5)11-17-15(4)19(24-7)13(2)9-21-17/h8-9H,10-11H2,1-7H3.
What are the key properties of 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine?
1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine has a molecular weight of 329.44 g/mol, XLogP of 3.36, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylmethanamine is sourced from PubChem (CID 169449567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).