1-(4-methoxyphenyl)-N-methyl-1-morpholin-3-ylmethanamine

C13H20N2O2 — CID 116956524

IUPAC1-(4-methoxyphenyl)-N-methyl-1-morpholin-3-ylmethanamine
SMILESCNC(c1ccc(OC)cc1)C1COCCN1
InChIInChI=1S/C13H20N2O2/c1-14-13(12-9-17-8-7-15-12)10-3-5-11(16-2)6-4-10/h3-6,12-15H,7-9H2,1-2H3
InChIKeyALHRLBVDYFQHSF-UHFFFAOYSA-N
MW236.31 g/mol
LogP0.94
Rot. Bonds4

About 1-(4-methoxyphenyl)-N-methyl-1-morpholin-3-ylmethanamine

1-(4-methoxyphenyl)-N-methyl-1-morpholin-3-ylmethanamine (PubChem CID 116956524) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-N-methyl-1-morpholin-3-ylmethanamine.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-N-methyl-1-morpholin-3-ylmethanamine
PubChem CID116956524
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name1-(4-methoxyphenyl)-N-methyl-1-morpholin-3-ylmethanamine
SMILESCNC(c1ccc(OC)cc1)C1COCCN1
InChIInChI=1S/C13H20N2O2/c1-14-13(12-9-17-8-7-15-12)10-3-5-11(16-2)6-4-10/h3-6,12-15H,7-9H2,1-2H3
InChIKeyALHRLBVDYFQHSF-UHFFFAOYSA-N
XLogP0.94
TPSA42.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-ethoxyphenyl)-N-methyl-1-morpholin-3-ylmethanamine
CID 116956547
1-(4-methoxyphenyl)-N-methyl-1-(oxolan-2-yl)methanamine
CID 43481680
1-cyclobutyl-1-(4-methoxyphenyl)-N-methylmethanamine
CID 43481696
4-[(4-methoxyphenyl)-(methylamino)methyl]-N-methylcyclohexan-1-amine
CID 116952347
N-[(4-methoxyphenyl)-(oxolan-3-yl)methyl]ethanamine
CID 61276481
N-[1,4-dioxan-2-yl-(4-methylphenyl)methyl]-4-methoxyaniline
CID 162409373
trans-(8R,9R)-8,9-bis(4-methoxyphenyl)-1,4-dioxa-7,10-diazacyclododecane
CID 10905147
3-(2,5-dimethoxyphenyl)sulfanylmorpholine
CID 117034229
N-methyl-1-(oxolan-3-yl)-1-(4-propan-2-yloxyphenyl)methanamine
CID 61276553
N-[(4-methoxyphenyl)methyl]-2-morpholin-3-ylethanamine
CID 115238941
3-[(2,5-dimethoxyphenyl)sulfanylmethyl]morpholine
CID 117034352
1-(4-cyclopropyloxyphenyl)-1-(1,4-dioxan-2-yl)-N-methylmethanamine
CID 105051615

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-N-methyl-1-morpholin-3-ylmethanamine?
The IUPAC name of 1-(4-methoxyphenyl)-N-methyl-1-morpholin-3-ylmethanamine (CID 116956524) is 1-(4-methoxyphenyl)-N-methyl-1-morpholin-3-ylmethanamine.
What is the SMILES notation for 1-(4-methoxyphenyl)-N-methyl-1-morpholin-3-ylmethanamine?
The canonical SMILES for 1-(4-methoxyphenyl)-N-methyl-1-morpholin-3-ylmethanamine is CNC(c1ccc(OC)cc1)C1COCCN1.
What is the InChIKey of 1-(4-methoxyphenyl)-N-methyl-1-morpholin-3-ylmethanamine?
The InChIKey is ALHRLBVDYFQHSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-14-13(12-9-17-8-7-15-12)10-3-5-11(16-2)6-4-10/h3-6,12-15H,7-9H2,1-2H3.
What are the key properties of 1-(4-methoxyphenyl)-N-methyl-1-morpholin-3-ylmethanamine?
1-(4-methoxyphenyl)-N-methyl-1-morpholin-3-ylmethanamine has a molecular weight of 236.31 g/mol, XLogP of 0.94, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-N-methyl-1-morpholin-3-ylmethanamine is sourced from PubChem (CID 116956524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).