2-(4-morpholin-4-ylanilino)-N-propan-2-ylacetamide

C15H23N3O2 — CID 60647079

IUPAC2-(4-morpholin-4-ylanilino)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CNc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C15H23N3O2/c1-12(2)17-15(19)11-16-13-3-5-14(6-4-13)18-7-9-20-10-8-18/h3-6,12,16H,7-11H2,1-2H3,(H,17,19)
InChIKeyHDEFRXLNWKYWPT-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.46
Rot. Bonds5

About 2-(4-morpholin-4-ylanilino)-N-propan-2-ylacetamide

2-(4-morpholin-4-ylanilino)-N-propan-2-ylacetamide (PubChem CID 60647079) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-(4-morpholin-4-ylanilino)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(4-morpholin-4-ylanilino)-N-propan-2-ylacetamide
PubChem CID60647079
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name2-(4-morpholin-4-ylanilino)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CNc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C15H23N3O2/c1-12(2)17-15(19)11-16-13-3-5-14(6-4-13)18-7-9-20-10-8-18/h3-6,12,16H,7-11H2,1-2H3,(H,17,19)
InChIKeyHDEFRXLNWKYWPT-UHFFFAOYSA-N
XLogP1.46
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

N-(cyanomethyl)-2-(4-morpholin-4-ylanilino)acetamide
CID 63180100
1-(4-morpholin-4-ylphenyl)-3-propan-2-ylurea
CID 47173524
N-(2-methylpropyl)-2-(4-piperidin-1-ylanilino)acetamide
CID 60647120
N-tert-butyl-4-[[2-(4-morpholin-4-ylanilino)-2-oxoethyl]amino]benzamide
CID 31699427
3-[4-(4-methylpiperazin-1-yl)anilino]-N-propan-2-ylpropanamide
CID 109011692
N-(3-methylbutyl)-2-(4-pyrrolidin-1-ylanilino)acetamide
CID 60674409
N-(3-methylbutyl)-4-morpholin-4-ylaniline
CID 28675688
2,3-dimethyl-1-(4-morpholin-4-ylanilino)butan-2-ol
CID 114493123
2-hydroxy-2-methyl-3-(4-morpholin-4-ylanilino)propanoic acid
CID 104644459
2-[4-(diethylsulfamoyl)anilino]-N-(4-morpholin-4-ylphenyl)acetamide
CID 4846803
2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride
CID 20847919
methyl 3-(4-morpholin-4-ylanilino)propanoate
CID 63180474

Frequently Asked Questions

What is the IUPAC name of 2-(4-morpholin-4-ylanilino)-N-propan-2-ylacetamide?
The IUPAC name of 2-(4-morpholin-4-ylanilino)-N-propan-2-ylacetamide (CID 60647079) is 2-(4-morpholin-4-ylanilino)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(4-morpholin-4-ylanilino)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(4-morpholin-4-ylanilino)-N-propan-2-ylacetamide is CC(C)NC(=O)CNc1ccc(N2CCOCC2)cc1.
What is the InChIKey of 2-(4-morpholin-4-ylanilino)-N-propan-2-ylacetamide?
The InChIKey is HDEFRXLNWKYWPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-12(2)17-15(19)11-16-13-3-5-14(6-4-13)18-7-9-20-10-8-18/h3-6,12,16H,7-11H2,1-2H3,(H,17,19).
What are the key properties of 2-(4-morpholin-4-ylanilino)-N-propan-2-ylacetamide?
2-(4-morpholin-4-ylanilino)-N-propan-2-ylacetamide has a molecular weight of 277.37 g/mol, XLogP of 1.46, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-morpholin-4-ylanilino)-N-propan-2-ylacetamide is sourced from PubChem (CID 60647079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).