(2,6-dimethylmorpholin-4-yl)-[2-(propylamino)phenyl]methanone

C16H24N2O2 — CID 62171334

IUPAC(2,6-dimethylmorpholin-4-yl)-[2-(propylamino)phenyl]methanone
SMILESCCCNc1ccccc1C(=O)N1CC(C)OC(C)C1
InChIInChI=1S/C16H24N2O2/c1-4-9-17-15-8-6-5-7-14(15)16(19)18-10-12(2)20-13(3)11-18/h5-8,12-13,17H,4,9-11H2,1-3H3
InChIKeyKBEWAMWETLRNAT-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.76
Rot. Bonds4

About (2,6-dimethylmorpholin-4-yl)-[2-(propylamino)phenyl]methanone

(2,6-dimethylmorpholin-4-yl)-[2-(propylamino)phenyl]methanone (PubChem CID 62171334) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is (2,6-dimethylmorpholin-4-yl)-[2-(propylamino)phenyl]methanone.

Molecular Properties

Compound Name(2,6-dimethylmorpholin-4-yl)-[2-(propylamino)phenyl]methanone
PubChem CID62171334
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name(2,6-dimethylmorpholin-4-yl)-[2-(propylamino)phenyl]methanone
SMILESCCCNc1ccccc1C(=O)N1CC(C)OC(C)C1
InChIInChI=1S/C16H24N2O2/c1-4-9-17-15-8-6-5-7-14(15)16(19)18-10-12(2)20-13(3)11-18/h5-8,12-13,17H,4,9-11H2,1-3H3
InChIKeyKBEWAMWETLRNAT-UHFFFAOYSA-N
XLogP2.76
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylmorpholin-4-yl)-[2-(propylamino)phenyl]methanone?
The IUPAC name of (2,6-dimethylmorpholin-4-yl)-[2-(propylamino)phenyl]methanone (CID 62171334) is (2,6-dimethylmorpholin-4-yl)-[2-(propylamino)phenyl]methanone.
What is the SMILES notation for (2,6-dimethylmorpholin-4-yl)-[2-(propylamino)phenyl]methanone?
The canonical SMILES for (2,6-dimethylmorpholin-4-yl)-[2-(propylamino)phenyl]methanone is CCCNc1ccccc1C(=O)N1CC(C)OC(C)C1.
What is the InChIKey of (2,6-dimethylmorpholin-4-yl)-[2-(propylamino)phenyl]methanone?
The InChIKey is KBEWAMWETLRNAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-4-9-17-15-8-6-5-7-14(15)16(19)18-10-12(2)20-13(3)11-18/h5-8,12-13,17H,4,9-11H2,1-3H3.
What are the key properties of (2,6-dimethylmorpholin-4-yl)-[2-(propylamino)phenyl]methanone?
(2,6-dimethylmorpholin-4-yl)-[2-(propylamino)phenyl]methanone has a molecular weight of 276.38 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethylmorpholin-4-yl)-[2-(propylamino)phenyl]methanone is sourced from PubChem (CID 62171334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).