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

C16H24N2O2 — CID 62170653

IUPAC(2,6-dimethylmorpholin-4-yl)-[4-(propylamino)phenyl]methanone
SMILESCCCNc1ccc(C(=O)N2CC(C)OC(C)C2)cc1
InChIInChI=1S/C16H24N2O2/c1-4-9-17-15-7-5-14(6-8-15)16(19)18-10-12(2)20-13(3)11-18/h5-8,12-13,17H,4,9-11H2,1-3H3
InChIKeyHGEJCOUDADONKF-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.76
Rot. Bonds4

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

(2,6-dimethylmorpholin-4-yl)-[4-(propylamino)phenyl]methanone (PubChem CID 62170653) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is (2,6-dimethylmorpholin-4-yl)-[4-(propylamino)phenyl]methanone.

Molecular Properties

Compound Name(2,6-dimethylmorpholin-4-yl)-[4-(propylamino)phenyl]methanone
PubChem CID62170653
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name(2,6-dimethylmorpholin-4-yl)-[4-(propylamino)phenyl]methanone
SMILESCCCNc1ccc(C(=O)N2CC(C)OC(C)C2)cc1
InChIInChI=1S/C16H24N2O2/c1-4-9-17-15-7-5-14(6-8-15)16(19)18-10-12(2)20-13(3)11-18/h5-8,12-13,17H,4,9-11H2,1-3H3
InChIKeyHGEJCOUDADONKF-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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Related Compounds

(2,6-dimethylmorpholin-4-yl)-[4-(ethylamino)phenyl]methanone
CID 62170652
[4-(propylamino)phenyl]-(3,4,5-trimethylpiperazin-1-yl)methanone
CID 114540449
[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-(2,6-dimethylmorpholin-4-yl)methanone
CID 618918
methyl 2-[4-[(2S,6R)-2,6-dimethylmorpholine-4-carbonyl]anilino]acetate
CID 94631757
(3-methylpyrrolidin-1-yl)-[4-(propylamino)phenyl]methanone
CID 62179564
[(2R,6R)-2,6-dimethylmorpholin-4-yl]-[4-[2-[(2S)-oxolan-2-yl]ethylamino]phenyl]methanone
CID 99828580
(3,4-dimethylpiperazin-1-yl)-[4-(propylamino)phenyl]methanone
CID 63605486
4-[[4-(2,6-dimethylmorpholine-4-carbonyl)anilino]methyl]benzoic acid
CID 122033835
1-(azocan-1-yl)-2-[4-[(2S,6S)-2,6-dimethylmorpholine-4-carbonyl]anilino]ethanone
CID 94631749
[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea
CID 42915501
[4-[(2-chloro-1,3-thiazol-5-yl)methylamino]phenyl]-(2,6-dimethylmorpholin-4-yl)methanone
CID 168582257
(2,6-dimethylmorpholin-4-yl)-[2-(propylamino)phenyl]methanone
CID 62171334

Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylmorpholin-4-yl)-[4-(propylamino)phenyl]methanone?
The IUPAC name of (2,6-dimethylmorpholin-4-yl)-[4-(propylamino)phenyl]methanone (CID 62170653) is (2,6-dimethylmorpholin-4-yl)-[4-(propylamino)phenyl]methanone.
What is the SMILES notation for (2,6-dimethylmorpholin-4-yl)-[4-(propylamino)phenyl]methanone?
The canonical SMILES for (2,6-dimethylmorpholin-4-yl)-[4-(propylamino)phenyl]methanone is CCCNc1ccc(C(=O)N2CC(C)OC(C)C2)cc1.
What is the InChIKey of (2,6-dimethylmorpholin-4-yl)-[4-(propylamino)phenyl]methanone?
The InChIKey is HGEJCOUDADONKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-4-9-17-15-7-5-14(6-8-15)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)-[4-(propylamino)phenyl]methanone?
(2,6-dimethylmorpholin-4-yl)-[4-(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)-[4-(propylamino)phenyl]methanone is sourced from PubChem (CID 62170653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).