2-(2-methylphenyl)-2-morpholin-4-ylpropan-1-amine

C14H22N2O — CID 54775990

IUPAC2-(2-methylphenyl)-2-morpholin-4-ylpropan-1-amine
SMILESCc1ccccc1C(C)(CN)N1CCOCC1
InChIInChI=1S/C14H22N2O/c1-12-5-3-4-6-13(12)14(2,11-15)16-7-9-17-10-8-16/h3-6H,7-11,15H2,1-2H3
InChIKeyVTGCZDKMZMQGAC-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.50
Rot. Bonds3

About 2-(2-methylphenyl)-2-morpholin-4-ylpropan-1-amine

2-(2-methylphenyl)-2-morpholin-4-ylpropan-1-amine (PubChem CID 54775990) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-(2-methylphenyl)-2-morpholin-4-ylpropan-1-amine.

Molecular Properties

Compound Name2-(2-methylphenyl)-2-morpholin-4-ylpropan-1-amine
PubChem CID54775990
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-(2-methylphenyl)-2-morpholin-4-ylpropan-1-amine
SMILESCc1ccccc1C(C)(CN)N1CCOCC1
InChIInChI=1S/C14H22N2O/c1-12-5-3-4-6-13(12)14(2,11-15)16-7-9-17-10-8-16/h3-6H,7-11,15H2,1-2H3
InChIKeyVTGCZDKMZMQGAC-UHFFFAOYSA-N
XLogP1.50
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylphenyl)-2-morpholin-4-ylpropan-1-amine?
The IUPAC name of 2-(2-methylphenyl)-2-morpholin-4-ylpropan-1-amine (CID 54775990) is 2-(2-methylphenyl)-2-morpholin-4-ylpropan-1-amine.
What is the SMILES notation for 2-(2-methylphenyl)-2-morpholin-4-ylpropan-1-amine?
The canonical SMILES for 2-(2-methylphenyl)-2-morpholin-4-ylpropan-1-amine is Cc1ccccc1C(C)(CN)N1CCOCC1.
What is the InChIKey of 2-(2-methylphenyl)-2-morpholin-4-ylpropan-1-amine?
The InChIKey is VTGCZDKMZMQGAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-12-5-3-4-6-13(12)14(2,11-15)16-7-9-17-10-8-16/h3-6H,7-11,15H2,1-2H3.
What are the key properties of 2-(2-methylphenyl)-2-morpholin-4-ylpropan-1-amine?
2-(2-methylphenyl)-2-morpholin-4-ylpropan-1-amine has a molecular weight of 234.34 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenyl)-2-morpholin-4-ylpropan-1-amine is sourced from PubChem (CID 54775990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).