2-(2,6-dimethylanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide

C21H25N3O3 — CID 54818171

IUPAC2-(2,6-dimethylanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide
SMILESCc1cccc(C)c1NCC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1
InChIInChI=1S/C21H25N3O3/c1-15-4-3-5-16(2)20(15)22-14-19(25)23-18-8-6-17(7-9-18)21(26)24-10-12-27-13-11-24/h3-9,22H,10-14H2,1-2H3,(H,23,25)
InChIKeyGIDQZTRPTDBMOI-UHFFFAOYSA-N
MW367.45 g/mol
LogP2.83
Rot. Bonds5

About 2-(2,6-dimethylanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide

2-(2,6-dimethylanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide (PubChem CID 54818171) has the molecular formula C21H25N3O3 and a molecular weight of 367.45 g/mol. Its IUPAC name is 2-(2,6-dimethylanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(2,6-dimethylanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide
PubChem CID54818171
Molecular FormulaC21H25N3O3
Molecular Weight367.45 g/mol
Exact Mass367.19
IUPAC Name2-(2,6-dimethylanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide
SMILESCc1cccc(C)c1NCC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1
InChIInChI=1S/C21H25N3O3/c1-15-4-3-5-16(2)20(15)22-14-19(25)23-18-8-6-17(7-9-18)21(26)24-10-12-27-13-11-24/h3-9,22H,10-14H2,1-2H3,(H,23,25)
InChIKeyGIDQZTRPTDBMOI-UHFFFAOYSA-N
XLogP2.83
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(morpholine-4-carbonyl)anilino]-N-phenylacetamide
CID 54832695
N-[2-methyl-3-[[2-[4-(morpholine-4-carbonyl)anilino]-2-oxoethyl]amino]phenyl]propanamide
CID 54845041
3-methyl-N-[4-[[2-[4-(morpholine-4-carbonyl)anilino]acetyl]amino]phenyl]butanamide
CID 54832093
4-[[2-[4-(morpholine-4-carbonyl)anilino]acetyl]amino]-N-propylbenzamide
CID 54831969
N-[4-(morpholine-4-carbonyl)phenyl]-2-[3-(piperidine-1-carbonyl)anilino]acetamide
CID 54843375
N-ethyl-4-[[2-[4-(morpholine-4-carbonyl)anilino]-2-oxoethyl]amino]benzamide
CID 54839441
2-(2-chloroanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide
CID 54810418
N-[4-(morpholine-4-carbonyl)phenyl]-2-(naphthalen-2-ylamino)acetamide
CID 54839830
N-(3-methoxyphenyl)-2-[4-(morpholine-4-carbonyl)anilino]acetamide
CID 54832632
N-[4-(morpholine-4-carbonyl)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide
CID 54833392
N-methyl-3-[[2-[4-(morpholine-4-carbonyl)anilino]acetyl]amino]benzamide
CID 54832192
2-[4-(morpholine-4-carbonyl)anilino]-N-[3-(piperidine-1-carbonyl)phenyl]acetamide
CID 54832001

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide?
The IUPAC name of 2-(2,6-dimethylanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide (CID 54818171) is 2-(2,6-dimethylanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide.
What is the SMILES notation for 2-(2,6-dimethylanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide?
The canonical SMILES for 2-(2,6-dimethylanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide is Cc1cccc(C)c1NCC(=O)Nc1ccc(C(=O)N2CCOCC2)cc1.
What is the InChIKey of 2-(2,6-dimethylanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide?
The InChIKey is GIDQZTRPTDBMOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O3/c1-15-4-3-5-16(2)20(15)22-14-19(25)23-18-8-6-17(7-9-18)21(26)24-10-12-27-13-11-24/h3-9,22H,10-14H2,1-2H3,(H,23,25).
What are the key properties of 2-(2,6-dimethylanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide?
2-(2,6-dimethylanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide has a molecular weight of 367.45 g/mol, XLogP of 2.83, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide is sourced from PubChem (CID 54818171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).