N-(3,5-dimethylphenyl)-2,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide

C19H28N2O3 — CID 110675011

IUPACN-(3,5-dimethylphenyl)-2,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide
SMILESCc1cc(C)cc(N(CC(=O)N2CCOCC2)C(=O)C(C)(C)C)c1
InChIInChI=1S/C19H28N2O3/c1-14-10-15(2)12-16(11-14)21(18(23)19(3,4)5)13-17(22)20-6-8-24-9-7-20/h10-12H,6-9,13H2,1-5H3
InChIKeyZMFUITZFJRFWBH-UHFFFAOYSA-N
MW332.44 g/mol
LogP2.54
Rot. Bonds3

About N-(3,5-dimethylphenyl)-2,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide

N-(3,5-dimethylphenyl)-2,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide (PubChem CID 110675011) has the molecular formula C19H28N2O3 and a molecular weight of 332.44 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-2,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-2,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide
PubChem CID110675011
Molecular FormulaC19H28N2O3
Molecular Weight332.44 g/mol
Exact Mass332.21
IUPAC NameN-(3,5-dimethylphenyl)-2,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide
SMILESCc1cc(C)cc(N(CC(=O)N2CCOCC2)C(=O)C(C)(C)C)c1
InChIInChI=1S/C19H28N2O3/c1-14-10-15(2)12-16(11-14)21(18(23)19(3,4)5)13-17(22)20-6-8-24-9-7-20/h10-12H,6-9,13H2,1-5H3
InChIKeyZMFUITZFJRFWBH-UHFFFAOYSA-N
XLogP2.54
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.44
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,5-dichlorophenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide
CID 113179820
ethyl 4-[2-(N-acetyl-3,5-dimethylanilino)acetyl]piperazine-1-carboxylate
CID 113168491
2-(4-methyl-N-(2-morpholin-4-yl-2-oxoethyl)anilino)acetic acid
CID 46299967
2-amino-N,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide;hydrochloride
CID 119290901
N,4-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)benzamide
CID 89468282
N-(2-chloro-4,6-dimethylphenyl)-N-(2-morpholin-4-yl-2-oxoethyl)methanesulfonamide
CID 113155009
2-[(1-amino-2-methylpropan-2-yl)-methylamino]-1-morpholin-4-ylethanone
CID 62007959
2-[4-(3,5-dimethylbenzoyl)piperazin-1-yl]-1-morpholin-4-ylethanone
CID 17441973
2-amino-N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)-2-phenylpropanamide
CID 120588933
N-(3-chloro-4-methoxyphenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide
CID 113172652
N-(3,5-dichlorophenyl)-N-(3-morpholin-4-yl-3-oxopropyl)acetamide
CID 113134062
N-(4-chloro-2-methoxy-5-methylphenyl)-N-(2-morpholin-4-yl-2-oxoethyl)acetamide
CID 113180300

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-2,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide?
The IUPAC name of N-(3,5-dimethylphenyl)-2,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide (CID 110675011) is N-(3,5-dimethylphenyl)-2,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-2,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-2,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide is Cc1cc(C)cc(N(CC(=O)N2CCOCC2)C(=O)C(C)(C)C)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-2,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide?
The InChIKey is ZMFUITZFJRFWBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O3/c1-14-10-15(2)12-16(11-14)21(18(23)19(3,4)5)13-17(22)20-6-8-24-9-7-20/h10-12H,6-9,13H2,1-5H3.
What are the key properties of N-(3,5-dimethylphenyl)-2,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide?
N-(3,5-dimethylphenyl)-2,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide has a molecular weight of 332.44 g/mol, XLogP of 2.54, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-2,2-dimethyl-N-(2-morpholin-4-yl-2-oxoethyl)propanamide is sourced from PubChem (CID 110675011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).