4-[2-(1-aminoethyl)morpholin-4-yl]-N-methylbutanamide

C11H23N3O2 — CID 115315500

IUPAC4-[2-(1-aminoethyl)morpholin-4-yl]-N-methylbutanamide
SMILESCNC(=O)CCCN1CCOC(C(C)N)C1
InChIInChI=1S/C11H23N3O2/c1-9(12)10-8-14(6-7-16-10)5-3-4-11(15)13-2/h9-10H,3-8,12H2,1-2H3,(H,13,15)
InChIKeyYIAFEKURMPHWAN-UHFFFAOYSA-N
MW229.32 g/mol
LogP-0.44
Rot. Bonds5

About 4-[2-(1-aminoethyl)morpholin-4-yl]-N-methylbutanamide

4-[2-(1-aminoethyl)morpholin-4-yl]-N-methylbutanamide (PubChem CID 115315500) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 4-[2-(1-aminoethyl)morpholin-4-yl]-N-methylbutanamide.

Molecular Properties

Compound Name4-[2-(1-aminoethyl)morpholin-4-yl]-N-methylbutanamide
PubChem CID115315500
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name4-[2-(1-aminoethyl)morpholin-4-yl]-N-methylbutanamide
SMILESCNC(=O)CCCN1CCOC(C(C)N)C1
InChIInChI=1S/C11H23N3O2/c1-9(12)10-8-14(6-7-16-10)5-3-4-11(15)13-2/h9-10H,3-8,12H2,1-2H3,(H,13,15)
InChIKeyYIAFEKURMPHWAN-UHFFFAOYSA-N
XLogP-0.44
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-[2-(1-aminoethyl)morpholin-4-yl]-N-methylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[4-(3-pyrrolidin-1-ylpropyl)morpholin-2-yl]ethanamine
CID 113285074
2-[4-[4-(methylamino)-4-oxobutyl]morpholin-2-yl]acetic acid
CID 66434649
1-(4-propylmorpholin-2-yl)ethanamine
CID 79658084
3-[2-(1-aminoethyl)morpholin-4-yl]-N-phenylpropanamide
CID 81490513
3-[2-(1-aminoethyl)morpholin-4-yl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 81491262
N-methyl-3-(2-methylmorpholin-4-yl)propanamide
CID 131041683
3-[2-(1-aminoethyl)morpholin-4-yl]-N-(3-chlorophenyl)propanamide
CID 81497387
4-[3-(aminomethyl)pyrrolidin-1-yl]-N-methylbutanamide
CID 63891241
N-methyl-7-morpholin-4-ylheptanamide
CID 176680363
1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]morpholin-2-yl]ethanamine
CID 112590973
N-methyl-4-[3-[1-(methylamino)ethyl]piperidin-1-yl]butanamide
CID 63891364
ethane;N-methyl-7-morpholin-4-ylheptanamide
CID 176680362

Frequently Asked Questions

What is the IUPAC name of 4-[2-(1-aminoethyl)morpholin-4-yl]-N-methylbutanamide?
The IUPAC name of 4-[2-(1-aminoethyl)morpholin-4-yl]-N-methylbutanamide (CID 115315500) is 4-[2-(1-aminoethyl)morpholin-4-yl]-N-methylbutanamide.
What is the SMILES notation for 4-[2-(1-aminoethyl)morpholin-4-yl]-N-methylbutanamide?
The canonical SMILES for 4-[2-(1-aminoethyl)morpholin-4-yl]-N-methylbutanamide is CNC(=O)CCCN1CCOC(C(C)N)C1.
What is the InChIKey of 4-[2-(1-aminoethyl)morpholin-4-yl]-N-methylbutanamide?
The InChIKey is YIAFEKURMPHWAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-9(12)10-8-14(6-7-16-10)5-3-4-11(15)13-2/h9-10H,3-8,12H2,1-2H3,(H,13,15).
What are the key properties of 4-[2-(1-aminoethyl)morpholin-4-yl]-N-methylbutanamide?
4-[2-(1-aminoethyl)morpholin-4-yl]-N-methylbutanamide has a molecular weight of 229.32 g/mol, XLogP of -0.44, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(1-aminoethyl)morpholin-4-yl]-N-methylbutanamide is sourced from PubChem (CID 115315500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).