1-(2-methoxy-5-methylphenyl)-N-methylmethanamine

C10H15NO — CID 4962726

IUPAC1-(2-methoxy-5-methylphenyl)-N-methylmethanamine
SMILESCNCc1cc(C)ccc1OC
InChIInChI=1S/C10H15NO/c1-8-4-5-10(12-3)9(6-8)7-11-2/h4-6,11H,7H2,1-3H3
InChIKeyIGPRRNIFQCPZDU-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.72
Rot. Bonds3

About 1-(2-methoxy-5-methylphenyl)-N-methylmethanamine

1-(2-methoxy-5-methylphenyl)-N-methylmethanamine (PubChem CID 4962726) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 1-(2-methoxy-5-methylphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2-methoxy-5-methylphenyl)-N-methylmethanamine
PubChem CID4962726
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name1-(2-methoxy-5-methylphenyl)-N-methylmethanamine
SMILESCNCc1cc(C)ccc1OC
InChIInChI=1S/C10H15NO/c1-8-4-5-10(12-3)9(6-8)7-11-2/h4-6,11H,7H2,1-3H3
InChIKeyIGPRRNIFQCPZDU-UHFFFAOYSA-N
XLogP1.72
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-5-methylphenyl)-N-methylmethanamine?
The IUPAC name of 1-(2-methoxy-5-methylphenyl)-N-methylmethanamine (CID 4962726) is 1-(2-methoxy-5-methylphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(2-methoxy-5-methylphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(2-methoxy-5-methylphenyl)-N-methylmethanamine is CNCc1cc(C)ccc1OC.
What is the InChIKey of 1-(2-methoxy-5-methylphenyl)-N-methylmethanamine?
The InChIKey is IGPRRNIFQCPZDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-8-4-5-10(12-3)9(6-8)7-11-2/h4-6,11H,7H2,1-3H3.
What are the key properties of 1-(2-methoxy-5-methylphenyl)-N-methylmethanamine?
1-(2-methoxy-5-methylphenyl)-N-methylmethanamine has a molecular weight of 165.24 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-5-methylphenyl)-N-methylmethanamine is sourced from PubChem (CID 4962726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).