(2R)-N-[2-(4-methylbenzoyl)phenyl]-2-morpholin-4-ylpropanamide

C21H24N2O3 — CID 97426909

IUPAC(2R)-N-[2-(4-methylbenzoyl)phenyl]-2-morpholin-4-ylpropanamide
SMILESCc1ccc(C(=O)c2ccccc2NC(=O)[C@@H](C)N2CCOCC2)cc1
InChIInChI=1S/C21H24N2O3/c1-15-7-9-17(10-8-15)20(24)18-5-3-4-6-19(18)22-21(25)16(2)23-11-13-26-14-12-23/h3-10,16H,11-14H2,1-2H3,(H,22,25)/t16-/m1/s1
InChIKeySMKCZYJGAARWFY-MRXNPFEDSA-N
MW352.43 g/mol
LogP2.89
Rot. Bonds5

About (2R)-N-[2-(4-methylbenzoyl)phenyl]-2-morpholin-4-ylpropanamide

(2R)-N-[2-(4-methylbenzoyl)phenyl]-2-morpholin-4-ylpropanamide (PubChem CID 97426909) has the molecular formula C21H24N2O3 and a molecular weight of 352.43 g/mol. Its IUPAC name is (2R)-N-[2-(4-methylbenzoyl)phenyl]-2-morpholin-4-ylpropanamide.

Molecular Properties

Compound Name(2R)-N-[2-(4-methylbenzoyl)phenyl]-2-morpholin-4-ylpropanamide
PubChem CID97426909
Molecular FormulaC21H24N2O3
Molecular Weight352.43 g/mol
Exact Mass352.18
IUPAC Name(2R)-N-[2-(4-methylbenzoyl)phenyl]-2-morpholin-4-ylpropanamide
SMILESCc1ccc(C(=O)c2ccccc2NC(=O)[C@@H](C)N2CCOCC2)cc1
InChIInChI=1S/C21H24N2O3/c1-15-7-9-17(10-8-15)20(24)18-5-3-4-6-19(18)22-21(25)16(2)23-11-13-26-14-12-23/h3-10,16H,11-14H2,1-2H3,(H,22,25)/t16-/m1/s1
InChIKeySMKCZYJGAARWFY-MRXNPFEDSA-N
XLogP2.89
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.43
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-benzoylphenyl)-2-morpholin-4-ylpropanamide
CID 17461516
(2R)-N-(2-benzoyl-4-methylphenyl)-2-morpholin-4-ylpropanamide
CID 6551381
(2S)-N-(2-benzoyl-4-methylphenyl)-2-piperidin-1-ylpropanamide
CID 1332847
(2R)-2-morpholin-4-yl-N-(2-phenylphenyl)propanamide
CID 1429478
(2S)-N-(2-benzoylphenyl)-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]propanamide
CID 27132550
N-(2,3-dichlorophenyl)-2-morpholin-4-ylpropanamide
CID 51167813
N-(2-methoxy-5-methylphenyl)-2-morpholin-4-ylpropanamide;hydrochloride
CID 2942225
2-(4-methylphenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide
CID 4933116
(2S)-N-(2-acetylphenyl)-2-(4-methylpiperazin-1-yl)propanamide
CID 9250084
N-[4-fluoro-3-(2-morpholin-4-ylpropanoylamino)phenyl]-4-phenylbenzamide
CID 123219708
N-[3-(2-morpholin-4-ylpropanoylamino)-4-(trifluoromethyl)phenyl]-4-phenylbenzamide
CID 90459105
4-(methoxymethyl)-3-(2-morpholin-4-ylpropanoylamino)-N-(4-phenylphenyl)benzamide
CID 90458981

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[2-(4-methylbenzoyl)phenyl]-2-morpholin-4-ylpropanamide?
The IUPAC name of (2R)-N-[2-(4-methylbenzoyl)phenyl]-2-morpholin-4-ylpropanamide (CID 97426909) is (2R)-N-[2-(4-methylbenzoyl)phenyl]-2-morpholin-4-ylpropanamide.
What is the SMILES notation for (2R)-N-[2-(4-methylbenzoyl)phenyl]-2-morpholin-4-ylpropanamide?
The canonical SMILES for (2R)-N-[2-(4-methylbenzoyl)phenyl]-2-morpholin-4-ylpropanamide is Cc1ccc(C(=O)c2ccccc2NC(=O)[C@@H](C)N2CCOCC2)cc1.
What is the InChIKey of (2R)-N-[2-(4-methylbenzoyl)phenyl]-2-morpholin-4-ylpropanamide?
The InChIKey is SMKCZYJGAARWFY-MRXNPFEDSA-N. The full InChI is InChI=1S/C21H24N2O3/c1-15-7-9-17(10-8-15)20(24)18-5-3-4-6-19(18)22-21(25)16(2)23-11-13-26-14-12-23/h3-10,16H,11-14H2,1-2H3,(H,22,25)/t16-/m1/s1.
What are the key properties of (2R)-N-[2-(4-methylbenzoyl)phenyl]-2-morpholin-4-ylpropanamide?
(2R)-N-[2-(4-methylbenzoyl)phenyl]-2-morpholin-4-ylpropanamide has a molecular weight of 352.43 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[2-(4-methylbenzoyl)phenyl]-2-morpholin-4-ylpropanamide is sourced from PubChem (CID 97426909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).