2-[(4-methylmorpholin-2-yl)methylamino]-N-propylacetamide

C11H23N3O2 — CID 78945295

IUPAC2-[(4-methylmorpholin-2-yl)methylamino]-N-propylacetamide
SMILESCCCNC(=O)CNCC1CN(C)CCO1
InChIInChI=1S/C11H23N3O2/c1-3-4-13-11(15)8-12-7-10-9-14(2)5-6-16-10/h10,12H,3-9H2,1-2H3,(H,13,15)
InChIKeyZQYLOKFNKZQTIV-UHFFFAOYSA-N
MW229.32 g/mol
LogP-0.57
Rot. Bonds6

About 2-[(4-methylmorpholin-2-yl)methylamino]-N-propylacetamide

2-[(4-methylmorpholin-2-yl)methylamino]-N-propylacetamide (PubChem CID 78945295) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 2-[(4-methylmorpholin-2-yl)methylamino]-N-propylacetamide.

Molecular Properties

Compound Name2-[(4-methylmorpholin-2-yl)methylamino]-N-propylacetamide
PubChem CID78945295
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name2-[(4-methylmorpholin-2-yl)methylamino]-N-propylacetamide
SMILESCCCNC(=O)CNCC1CN(C)CCO1
InChIInChI=1S/C11H23N3O2/c1-3-4-13-11(15)8-12-7-10-9-14(2)5-6-16-10/h10,12H,3-9H2,1-2H3,(H,13,15)
InChIKeyZQYLOKFNKZQTIV-UHFFFAOYSA-N
XLogP-0.57
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 5-0.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(4-ethylmorpholin-2-yl)methylamino]-N-propylacetamide
CID 78960685
2-[(4-methylmorpholin-2-yl)methylamino]-N-pentan-3-ylacetamide
CID 78945150
2-[[(2S)-4-methylmorpholin-2-yl]methylamino]-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
CID 96998898
N-(3-methylbutan-2-yl)-2-[(4-methylmorpholin-2-yl)methylamino]acetamide
CID 78945317
3-[[(2R)-4-methylmorpholin-2-yl]methylamino]propanoic acid
CID 95328025
2-amino-N-[2-[(4-methylmorpholin-2-yl)methylamino]-2-oxoethyl]acetamide
CID 79082878
3-[(4-ethylmorpholin-2-yl)methylamino]-N-propylpropanamide
CID 79165758
N-[(4-methylmorpholin-2-yl)methyl]acetamide
CID 69087754
N-[[(2S)-4-methylmorpholin-2-yl]methyl]acetamide
CID 170608678
3-[(4-methylmorpholin-2-yl)methylamino]propanamide
CID 78945349
N-butan-2-yl-3-[(4-methylmorpholin-2-yl)methylamino]propanamide
CID 79172289
2-[4-[[2-oxo-2-(propylamino)ethyl]carbamoyl]morpholin-2-yl]acetic acid
CID 66433095

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methylmorpholin-2-yl)methylamino]-N-propylacetamide?
The IUPAC name of 2-[(4-methylmorpholin-2-yl)methylamino]-N-propylacetamide (CID 78945295) is 2-[(4-methylmorpholin-2-yl)methylamino]-N-propylacetamide.
What is the SMILES notation for 2-[(4-methylmorpholin-2-yl)methylamino]-N-propylacetamide?
The canonical SMILES for 2-[(4-methylmorpholin-2-yl)methylamino]-N-propylacetamide is CCCNC(=O)CNCC1CN(C)CCO1.
What is the InChIKey of 2-[(4-methylmorpholin-2-yl)methylamino]-N-propylacetamide?
The InChIKey is ZQYLOKFNKZQTIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-3-4-13-11(15)8-12-7-10-9-14(2)5-6-16-10/h10,12H,3-9H2,1-2H3,(H,13,15).
What are the key properties of 2-[(4-methylmorpholin-2-yl)methylamino]-N-propylacetamide?
2-[(4-methylmorpholin-2-yl)methylamino]-N-propylacetamide has a molecular weight of 229.32 g/mol, XLogP of -0.57, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methylmorpholin-2-yl)methylamino]-N-propylacetamide is sourced from PubChem (CID 78945295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).