1-[4-(2-methoxy-5-methylphenyl)morpholin-2-yl]-N-methylmethanamine

C14H22N2O2 — CID 82297538

IUPAC1-[4-(2-methoxy-5-methylphenyl)morpholin-2-yl]-N-methylmethanamine
SMILESCNCC1CN(c2cc(C)ccc2OC)CCO1
InChIInChI=1S/C14H22N2O2/c1-11-4-5-14(17-3)13(8-11)16-6-7-18-12(10-16)9-15-2/h4-5,8,12,15H,6-7,9-10H2,1-3H3
InChIKeyJIIAGAIJOLXRAA-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.43
Rot. Bonds4

About 1-[4-(2-methoxy-5-methylphenyl)morpholin-2-yl]-N-methylmethanamine

1-[4-(2-methoxy-5-methylphenyl)morpholin-2-yl]-N-methylmethanamine (PubChem CID 82297538) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 1-[4-(2-methoxy-5-methylphenyl)morpholin-2-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[4-(2-methoxy-5-methylphenyl)morpholin-2-yl]-N-methylmethanamine
PubChem CID82297538
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name1-[4-(2-methoxy-5-methylphenyl)morpholin-2-yl]-N-methylmethanamine
SMILESCNCC1CN(c2cc(C)ccc2OC)CCO1
InChIInChI=1S/C14H22N2O2/c1-11-4-5-14(17-3)13(8-11)16-6-7-18-12(10-16)9-15-2/h4-5,8,12,15H,6-7,9-10H2,1-3H3
InChIKeyJIIAGAIJOLXRAA-UHFFFAOYSA-N
XLogP1.43
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-methoxy-5-methylphenyl)morpholin-2-yl]-N-methylmethanamine?
The IUPAC name of 1-[4-(2-methoxy-5-methylphenyl)morpholin-2-yl]-N-methylmethanamine (CID 82297538) is 1-[4-(2-methoxy-5-methylphenyl)morpholin-2-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[4-(2-methoxy-5-methylphenyl)morpholin-2-yl]-N-methylmethanamine?
The canonical SMILES for 1-[4-(2-methoxy-5-methylphenyl)morpholin-2-yl]-N-methylmethanamine is CNCC1CN(c2cc(C)ccc2OC)CCO1.
What is the InChIKey of 1-[4-(2-methoxy-5-methylphenyl)morpholin-2-yl]-N-methylmethanamine?
The InChIKey is JIIAGAIJOLXRAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-11-4-5-14(17-3)13(8-11)16-6-7-18-12(10-16)9-15-2/h4-5,8,12,15H,6-7,9-10H2,1-3H3.
What are the key properties of 1-[4-(2-methoxy-5-methylphenyl)morpholin-2-yl]-N-methylmethanamine?
1-[4-(2-methoxy-5-methylphenyl)morpholin-2-yl]-N-methylmethanamine has a molecular weight of 250.34 g/mol, XLogP of 1.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-methoxy-5-methylphenyl)morpholin-2-yl]-N-methylmethanamine is sourced from PubChem (CID 82297538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).