2-amino-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]-2-phenylpropanamide

C20H23N3O3 — CID 69467024

IUPAC2-amino-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]-2-phenylpropanamide
SMILESCc1cc(NC(=O)C(C)(N)c2ccccc2)ccc1N1CCOCC1=O
InChIInChI=1S/C20H23N3O3/c1-14-12-16(8-9-17(14)23-10-11-26-13-18(23)24)22-19(25)20(2,21)15-6-4-3-5-7-15/h3-9,12H,10-11,13,21H2,1-2H3,(H,22,25)
InChIKeyYUAJBOUJIQIRNI-UHFFFAOYSA-N
MW353.42 g/mol
LogP2.17
Rot. Bonds4

About 2-amino-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]-2-phenylpropanamide

2-amino-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]-2-phenylpropanamide (PubChem CID 69467024) has the molecular formula C20H23N3O3 and a molecular weight of 353.42 g/mol. Its IUPAC name is 2-amino-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]-2-phenylpropanamide.

Molecular Properties

Compound Name2-amino-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]-2-phenylpropanamide
PubChem CID69467024
Molecular FormulaC20H23N3O3
Molecular Weight353.42 g/mol
Exact Mass353.17
IUPAC Name2-amino-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]-2-phenylpropanamide
SMILESCc1cc(NC(=O)C(C)(N)c2ccccc2)ccc1N1CCOCC1=O
InChIInChI=1S/C20H23N3O3/c1-14-12-16(8-9-17(14)23-10-11-26-13-18(23)24)22-19(25)20(2,21)15-6-4-3-5-7-15/h3-9,12H,10-11,13,21H2,1-2H3,(H,22,25)
InChIKeyYUAJBOUJIQIRNI-UHFFFAOYSA-N
XLogP2.17
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl (2R)-2-[amino(methoxy)methyl]-2-methyl-3-[3-methyl-4-(3-oxomorpholin-4-yl)anilino]-3-oxopropanoate
CID 69052951
2-amino-N-(4-bromo-3-methylphenyl)-2-phenylpropanamide
CID 62488915
N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]pent-4-ynamide
CID 87236086
2-amino-N-[3-(2-oxopyrrolidin-1-yl)phenyl]-2-phenylpropanamide
CID 120587349
(5-chlorothiophen-2-yl) N-[2-[3-methyl-4-(3-oxomorpholin-4-yl)anilino]-2-oxo-1-phenylethyl]carbamate
CID 91492676
2-amino-N-[4-(1-morpholin-4-ylethyl)phenyl]-2-phenylpropanamide;dihydrochloride
CID 120596567
4-methyl-3-(3-oxomorpholin-4-yl)benzoic acid
CID 82513246
2-amino-N-(6-morpholin-4-yl-3-pyridinyl)-2-phenylpropanamide;dihydrochloride
CID 120595013
2-amino-N-(2,3-dihydro-1-benzofuran-5-yl)-2-phenylpropanamide
CID 62488581
4-[(2-amino-2-phenylpropanoyl)amino]-2-methyl-N-propan-2-ylbenzamide
CID 120592023
tert-butyl N-[2-[(5-chlorothiophene-2-carbonyl)amino]-3-[3-methyl-4-(3-oxomorpholin-4-yl)anilino]-3-oxopropyl]carbamate
CID 68884023
3-N-(4-chlorophenyl)-4-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]-1,3-thiazolidine-3,4-dicarboxamide
CID 66593247

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]-2-phenylpropanamide?
The IUPAC name of 2-amino-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]-2-phenylpropanamide (CID 69467024) is 2-amino-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]-2-phenylpropanamide.
What is the SMILES notation for 2-amino-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]-2-phenylpropanamide?
The canonical SMILES for 2-amino-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]-2-phenylpropanamide is Cc1cc(NC(=O)C(C)(N)c2ccccc2)ccc1N1CCOCC1=O.
What is the InChIKey of 2-amino-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]-2-phenylpropanamide?
The InChIKey is YUAJBOUJIQIRNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O3/c1-14-12-16(8-9-17(14)23-10-11-26-13-18(23)24)22-19(25)20(2,21)15-6-4-3-5-7-15/h3-9,12H,10-11,13,21H2,1-2H3,(H,22,25).
What are the key properties of 2-amino-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]-2-phenylpropanamide?
2-amino-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]-2-phenylpropanamide has a molecular weight of 353.42 g/mol, XLogP of 2.17, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]-2-phenylpropanamide is sourced from PubChem (CID 69467024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).