4-methyl-4-(4-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]pentanamide

C21H33N3O3 — CID 110305480

IUPAC4-methyl-4-(4-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]pentanamide
SMILESCc1ccc(C(C)(C)CCC(=O)NCC(=O)NCCN2CCOCC2)cc1
InChIInChI=1S/C21H33N3O3/c1-17-4-6-18(7-5-17)21(2,3)9-8-19(25)23-16-20(26)22-10-11-24-12-14-27-15-13-24/h4-7H,8-16H2,1-3H3,(H,22,26)(H,23,25)
InChIKeySEDRKZZQOGAHTP-UHFFFAOYSA-N
MW375.51 g/mol
LogP1.62
Rot. Bonds9

About 4-methyl-4-(4-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]pentanamide

4-methyl-4-(4-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]pentanamide (PubChem CID 110305480) has the molecular formula C21H33N3O3 and a molecular weight of 375.51 g/mol. Its IUPAC name is 4-methyl-4-(4-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]pentanamide.

Molecular Properties

Compound Name4-methyl-4-(4-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]pentanamide
PubChem CID110305480
Molecular FormulaC21H33N3O3
Molecular Weight375.51 g/mol
Exact Mass375.25
IUPAC Name4-methyl-4-(4-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]pentanamide
SMILESCc1ccc(C(C)(C)CCC(=O)NCC(=O)NCCN2CCOCC2)cc1
InChIInChI=1S/C21H33N3O3/c1-17-4-6-18(7-5-17)21(2,3)9-8-19(25)23-16-20(26)22-10-11-24-12-14-27-15-13-24/h4-7H,8-16H2,1-3H3,(H,22,26)(H,23,25)
InChIKeySEDRKZZQOGAHTP-UHFFFAOYSA-N
XLogP1.62
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.51
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-methyl-4-(4-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]pentanamide with MolForge

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Related Compounds

4-methyl-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-4-phenylpentanamide
CID 110353950
3-(4-methylanilino)-N-(2-morpholin-4-ylethyl)propanamide
CID 109016587
4-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 803484
3-(2,5-dimethylanilino)-N-(2-morpholin-4-ylethyl)propanamide
CID 109016591
2-(2-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]acetamide
CID 112991530
1-[2-(4-fluorophenyl)-2-methylpropyl]-3-(2-morpholin-4-ylethyl)urea
CID 113213344
3-[3-(4-methylphenyl)-6-oxo-4,5-dihydropyridazin-1-yl]-N-(2-morpholin-4-ylethyl)propanamide
CID 46372556
1-(4-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-5-(trifluoromethyl)pyrazole-4-carboxamide
CID 86933154
1-methyl-5-(4-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]pyrazole-3-carboxamide
CID 110305501
3-(4-fluoroanilino)-N-(2-morpholin-4-ylethyl)propanamide
CID 109016608
N-(2-morpholin-4-ylethyl)-3-[2-(trifluoromethyl)anilino]propanamide
CID 109016632
4-(2-chlorophenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-4-oxobutanamide
CID 110625338

Frequently Asked Questions

What is the IUPAC name of 4-methyl-4-(4-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]pentanamide?
The IUPAC name of 4-methyl-4-(4-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]pentanamide (CID 110305480) is 4-methyl-4-(4-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]pentanamide.
What is the SMILES notation for 4-methyl-4-(4-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]pentanamide?
The canonical SMILES for 4-methyl-4-(4-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]pentanamide is Cc1ccc(C(C)(C)CCC(=O)NCC(=O)NCCN2CCOCC2)cc1.
What is the InChIKey of 4-methyl-4-(4-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]pentanamide?
The InChIKey is SEDRKZZQOGAHTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H33N3O3/c1-17-4-6-18(7-5-17)21(2,3)9-8-19(25)23-16-20(26)22-10-11-24-12-14-27-15-13-24/h4-7H,8-16H2,1-3H3,(H,22,26)(H,23,25).
What are the key properties of 4-methyl-4-(4-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]pentanamide?
4-methyl-4-(4-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]pentanamide has a molecular weight of 375.51 g/mol, XLogP of 1.62, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-4-(4-methylphenyl)-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]pentanamide is sourced from PubChem (CID 110305480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).