N-butyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]acetamide

C12H23N3O3 — CID 113406059

IUPACN-butyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]acetamide
SMILESCCCCNC(=O)CNCC(=O)N1CCOCC1
InChIInChI=1S/C12H23N3O3/c1-2-3-4-14-11(16)9-13-10-12(17)15-5-7-18-8-6-15/h13H,2-10H2,1H3,(H,14,16)
InChIKeyXXQUBSHGLISKKC-UHFFFAOYSA-N
MW257.33 g/mol
LogP-0.65
Rot. Bonds7

About N-butyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]acetamide

N-butyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]acetamide (PubChem CID 113406059) has the molecular formula C12H23N3O3 and a molecular weight of 257.33 g/mol. Its IUPAC name is N-butyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]acetamide.

Molecular Properties

Compound NameN-butyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]acetamide
PubChem CID113406059
Molecular FormulaC12H23N3O3
Molecular Weight257.33 g/mol
Exact Mass257.17
IUPAC NameN-butyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]acetamide
SMILESCCCCNC(=O)CNCC(=O)N1CCOCC1
InChIInChI=1S/C12H23N3O3/c1-2-3-4-14-11(16)9-13-10-12(17)15-5-7-18-8-6-15/h13H,2-10H2,1H3,(H,14,16)
InChIKeyXXQUBSHGLISKKC-UHFFFAOYSA-N
XLogP-0.65
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 5-0.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-butyl-2-[(2-oxo-2-piperidin-1-ylethyl)amino]acetamide
CID 112685302
N-[2-[(2-morpholin-4-yl-2-oxoethyl)amino]ethyl]acetamide
CID 43400877
N-butyl-2-[(3-oxo-3-piperidin-1-ylpropyl)amino]acetamide
CID 115586639
N-(butylcarbamoyl)-2-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]acetamide
CID 55412983
2-(3-ethoxypropylamino)-1-morpholin-4-ylethanone
CID 28584674
1-morpholin-4-yl-2-(3-morpholin-4-ylpropylamino)ethanone
CID 43091152
2-[(2-hydroxy-2-methylpentyl)amino]-1-morpholin-4-ylethanone
CID 114169442
2-(4-methoxybutylamino)-1-morpholin-4-ylethanone
CID 60975832
2-(3-methylpentan-3-ylamino)-1-morpholin-4-ylethanone
CID 103746720
1-(morpholine-4-carbonyl)-N-pentylcyclopropane-1-carboxamide
CID 108973097
N-butyl-2-(2,2-dimethylpropylamino)acetamide
CID 61485526
ethane;1-morpholin-4-ylhexan-1-one
CID 143214280

Frequently Asked Questions

What is the IUPAC name of N-butyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]acetamide?
The IUPAC name of N-butyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]acetamide (CID 113406059) is N-butyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]acetamide.
What is the SMILES notation for N-butyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]acetamide?
The canonical SMILES for N-butyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]acetamide is CCCCNC(=O)CNCC(=O)N1CCOCC1.
What is the InChIKey of N-butyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]acetamide?
The InChIKey is XXQUBSHGLISKKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O3/c1-2-3-4-14-11(16)9-13-10-12(17)15-5-7-18-8-6-15/h13H,2-10H2,1H3,(H,14,16).
What are the key properties of N-butyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]acetamide?
N-butyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]acetamide has a molecular weight of 257.33 g/mol, XLogP of -0.65, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]acetamide is sourced from PubChem (CID 113406059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).