2-[3-chloro-4-(morpholine-4-carbonyl)anilino]-N-phenylacetamide

C19H20ClN3O3 — CID 60538956

IUPAC2-[3-chloro-4-(morpholine-4-carbonyl)anilino]-N-phenylacetamide
SMILESO=C(CNc1ccc(C(=O)N2CCOCC2)c(Cl)c1)Nc1ccccc1
InChIInChI=1S/C19H20ClN3O3/c20-17-12-15(21-13-18(24)22-14-4-2-1-3-5-14)6-7-16(17)19(25)23-8-10-26-11-9-23/h1-7,12,21H,8-11,13H2,(H,22,24)
InChIKeyHOPVMYCLDPJJIH-UHFFFAOYSA-N
MW373.84 g/mol
LogP2.86
Rot. Bonds5

About 2-[3-chloro-4-(morpholine-4-carbonyl)anilino]-N-phenylacetamide

2-[3-chloro-4-(morpholine-4-carbonyl)anilino]-N-phenylacetamide (PubChem CID 60538956) has the molecular formula C19H20ClN3O3 and a molecular weight of 373.84 g/mol. Its IUPAC name is 2-[3-chloro-4-(morpholine-4-carbonyl)anilino]-N-phenylacetamide.

Molecular Properties

Compound Name2-[3-chloro-4-(morpholine-4-carbonyl)anilino]-N-phenylacetamide
PubChem CID60538956
Molecular FormulaC19H20ClN3O3
Molecular Weight373.84 g/mol
Exact Mass373.12
IUPAC Name2-[3-chloro-4-(morpholine-4-carbonyl)anilino]-N-phenylacetamide
SMILESO=C(CNc1ccc(C(=O)N2CCOCC2)c(Cl)c1)Nc1ccccc1
InChIInChI=1S/C19H20ClN3O3/c20-17-12-15(21-13-18(24)22-14-4-2-1-3-5-14)6-7-16(17)19(25)23-8-10-26-11-9-23/h1-7,12,21H,8-11,13H2,(H,22,24)
InChIKeyHOPVMYCLDPJJIH-UHFFFAOYSA-N
XLogP2.86
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.84
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[3-chloro-4-(morpholine-4-carbonyl)anilino]-N-propylacetamide
CID 60539207
2-[4-(morpholine-4-carbonyl)anilino]-N-phenylacetamide
CID 54832695
N-[4-(morpholine-4-carbonyl)phenyl]-2-(naphthalen-2-ylamino)acetamide
CID 54839830
2-(2-chloroanilino)-N-[4-(morpholine-4-carbonyl)phenyl]acetamide
CID 54810418
[2-chloro-4-[(3-methylphenyl)methylamino]phenyl]-morpholin-4-ylmethanone
CID 60538980
N-[4-[[2-[3-(morpholine-4-carbonyl)anilino]acetyl]amino]phenyl]-3-phenylpropanamide
CID 54836716
N-[3-chloro-4-(morpholine-4-carbonyl)phenyl]-4-(methylamino)butanamide
CID 119712417
N-[4-(morpholine-4-carbonyl)phenyl]-2-[3-(piperidine-1-carbonyl)anilino]acetamide
CID 54843375
2-[3-(morpholine-4-carbonyl)anilino]-N-[3-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 54836347
2-(4-methyl-3-morpholin-4-ylsulfonylanilino)-N-phenylacetamide
CID 9100328
N-[4-(morpholine-4-carbonyl)phenyl]-2-[3-(trifluoromethyl)anilino]acetamide
CID 54833392
N-[4-[[2-[4-(morpholine-4-carbonyl)anilino]-2-oxoethyl]amino]phenyl]-3-phenylpropanamide
CID 54839339

Frequently Asked Questions

What is the IUPAC name of 2-[3-chloro-4-(morpholine-4-carbonyl)anilino]-N-phenylacetamide?
The IUPAC name of 2-[3-chloro-4-(morpholine-4-carbonyl)anilino]-N-phenylacetamide (CID 60538956) is 2-[3-chloro-4-(morpholine-4-carbonyl)anilino]-N-phenylacetamide.
What is the SMILES notation for 2-[3-chloro-4-(morpholine-4-carbonyl)anilino]-N-phenylacetamide?
The canonical SMILES for 2-[3-chloro-4-(morpholine-4-carbonyl)anilino]-N-phenylacetamide is O=C(CNc1ccc(C(=O)N2CCOCC2)c(Cl)c1)Nc1ccccc1.
What is the InChIKey of 2-[3-chloro-4-(morpholine-4-carbonyl)anilino]-N-phenylacetamide?
The InChIKey is HOPVMYCLDPJJIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClN3O3/c20-17-12-15(21-13-18(24)22-14-4-2-1-3-5-14)6-7-16(17)19(25)23-8-10-26-11-9-23/h1-7,12,21H,8-11,13H2,(H,22,24).
What are the key properties of 2-[3-chloro-4-(morpholine-4-carbonyl)anilino]-N-phenylacetamide?
2-[3-chloro-4-(morpholine-4-carbonyl)anilino]-N-phenylacetamide has a molecular weight of 373.84 g/mol, XLogP of 2.86, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-chloro-4-(morpholine-4-carbonyl)anilino]-N-phenylacetamide is sourced from PubChem (CID 60538956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).