2-(3-butan-2-yloxyanilino)-1-morpholin-4-ylethanone

C16H24N2O3 — CID 54830369

IUPAC2-(3-butan-2-yloxyanilino)-1-morpholin-4-ylethanone
SMILESCCC(C)Oc1cccc(NCC(=O)N2CCOCC2)c1
InChIInChI=1S/C16H24N2O3/c1-3-13(2)21-15-6-4-5-14(11-15)17-12-16(19)18-7-9-20-10-8-18/h4-6,11,13,17H,3,7-10,12H2,1-2H3
InChIKeyYQCFQBKCFQPYDB-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.13
Rot. Bonds6

About 2-(3-butan-2-yloxyanilino)-1-morpholin-4-ylethanone

2-(3-butan-2-yloxyanilino)-1-morpholin-4-ylethanone (PubChem CID 54830369) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-(3-butan-2-yloxyanilino)-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-(3-butan-2-yloxyanilino)-1-morpholin-4-ylethanone
PubChem CID54830369
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-(3-butan-2-yloxyanilino)-1-morpholin-4-ylethanone
SMILESCCC(C)Oc1cccc(NCC(=O)N2CCOCC2)c1
InChIInChI=1S/C16H24N2O3/c1-3-13(2)21-15-6-4-5-14(11-15)17-12-16(19)18-7-9-20-10-8-18/h4-6,11,13,17H,3,7-10,12H2,1-2H3
InChIKeyYQCFQBKCFQPYDB-UHFFFAOYSA-N
XLogP2.13
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(3-butan-2-yloxyanilino)-1-morpholin-4-ylethanone 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

2-(3-butan-2-yloxyanilino)-1-pyrrolidin-1-ylethanone
CID 62328413
2-(3-butan-2-yloxyanilino)acetic acid
CID 62328764
2-(3-tert-butylanilino)-1-morpholin-4-ylethanone
CID 59090711
2-(3-butan-2-yloxyanilino)-N-methylacetamide
CID 54830374
2-(3-chloroanilino)-1-morpholin-4-ylethanone
CID 28580621
2-(3-butan-2-yloxyanilino)-N-(2-methylbutan-2-yl)acetamide
CID 62328408
ethyl 1-[2-(3-propan-2-yloxyanilino)acetyl]piperidine-4-carboxylate
CID 54830182
1-(azepan-1-yl)-2-(3-propoxyanilino)ethanone
CID 54824937
4-amino-N-(3-butan-2-yloxyphenyl)oxane-4-carboxamide
CID 115294807
3-(3-butan-2-yloxyanilino)-2,2-dimethylpropanoic acid
CID 79624884
ethyl 1-[2-[3-(morpholine-4-carbonyl)anilino]acetyl]piperidine-4-carboxylate
CID 54836624
1-morpholin-4-yl-2-(3-pyrrolidin-1-ylsulfonylanilino)ethanone
CID 4009166

Frequently Asked Questions

What is the IUPAC name of 2-(3-butan-2-yloxyanilino)-1-morpholin-4-ylethanone?
The IUPAC name of 2-(3-butan-2-yloxyanilino)-1-morpholin-4-ylethanone (CID 54830369) is 2-(3-butan-2-yloxyanilino)-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-(3-butan-2-yloxyanilino)-1-morpholin-4-ylethanone?
The canonical SMILES for 2-(3-butan-2-yloxyanilino)-1-morpholin-4-ylethanone is CCC(C)Oc1cccc(NCC(=O)N2CCOCC2)c1.
What is the InChIKey of 2-(3-butan-2-yloxyanilino)-1-morpholin-4-ylethanone?
The InChIKey is YQCFQBKCFQPYDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-3-13(2)21-15-6-4-5-14(11-15)17-12-16(19)18-7-9-20-10-8-18/h4-6,11,13,17H,3,7-10,12H2,1-2H3.
What are the key properties of 2-(3-butan-2-yloxyanilino)-1-morpholin-4-ylethanone?
2-(3-butan-2-yloxyanilino)-1-morpholin-4-ylethanone has a molecular weight of 292.38 g/mol, XLogP of 2.13, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-butan-2-yloxyanilino)-1-morpholin-4-ylethanone is sourced from PubChem (CID 54830369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).