N-[(1S)-3-methyl-1-(2-methylphenyl)butyl]-2-[(2S)-morpholin-2-yl]acetamide

C18H28N2O2 — CID 129393193

IUPACN-[(1S)-3-methyl-1-(2-methylphenyl)butyl]-2-[(2S)-morpholin-2-yl]acetamide
SMILESCc1ccccc1[C@H](CC(C)C)NC(=O)C[C@H]1CNCCO1
InChIInChI=1S/C18H28N2O2/c1-13(2)10-17(16-7-5-4-6-14(16)3)20-18(21)11-15-12-19-8-9-22-15/h4-7,13,15,17,19H,8-12H2,1-3H3,(H,20,21)/t15-,17-/m0/s1
InChIKeyYUIHUEQYQIUGRQ-RDJZCZTQSA-N
MW304.43 g/mol
LogP2.58
Rot. Bonds6

About N-[(1S)-3-methyl-1-(2-methylphenyl)butyl]-2-[(2S)-morpholin-2-yl]acetamide

N-[(1S)-3-methyl-1-(2-methylphenyl)butyl]-2-[(2S)-morpholin-2-yl]acetamide (PubChem CID 129393193) has the molecular formula C18H28N2O2 and a molecular weight of 304.43 g/mol. Its IUPAC name is N-[(1S)-3-methyl-1-(2-methylphenyl)butyl]-2-[(2S)-morpholin-2-yl]acetamide.

Molecular Properties

Compound NameN-[(1S)-3-methyl-1-(2-methylphenyl)butyl]-2-[(2S)-morpholin-2-yl]acetamide
PubChem CID129393193
Molecular FormulaC18H28N2O2
Molecular Weight304.43 g/mol
Exact Mass304.22
IUPAC NameN-[(1S)-3-methyl-1-(2-methylphenyl)butyl]-2-[(2S)-morpholin-2-yl]acetamide
SMILESCc1ccccc1[C@H](CC(C)C)NC(=O)C[C@H]1CNCCO1
InChIInChI=1S/C18H28N2O2/c1-13(2)10-17(16-7-5-4-6-14(16)3)20-18(21)11-15-12-19-8-9-22-15/h4-7,13,15,17,19H,8-12H2,1-3H3,(H,20,21)/t15-,17-/m0/s1
InChIKeyYUIHUEQYQIUGRQ-RDJZCZTQSA-N
XLogP2.58
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.43
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(1S)-3-methyl-1-(2-methylphenyl)butyl]-2-[(2S)-morpholin-2-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-morpholin-2-yl-N-(1-phenylpropyl)acetamide
CID 66427474
2-morpholin-2-yl-N-(4-phenylbutan-2-yl)acetamide
CID 66428944
N-[3-methyl-1-(2-methylphenyl)butyl]piperidine-3-carboxamide;hydrochloride
CID 119323136
N-benzhydryl-2-morpholin-2-ylacetamide;hydrochloride
CID 119675556
N-[1-[2-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide;hydrochloride
CID 119716597
N-[(1S)-1-(furan-2-yl)ethyl]-2-morpholin-2-ylacetamide
CID 81400402
3-[(2-morpholin-2-ylacetyl)amino]-3-thiophen-2-ylpropanoic acid
CID 66429537
N-[3-methyl-1-(2-methylphenyl)butyl]piperidine-4-carboxamide;hydrochloride
CID 119323124
N-(2,6-dimethylphenyl)-2-morpholin-2-ylacetamide;hydrochloride
CID 119676388
N-[1-(5-methylthiophen-2-yl)propan-2-yl]-2-morpholin-2-ylacetamide;hydrochloride
CID 119796743
2-morpholin-2-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride
CID 119686106
N-[2-methyl-1-(2-methylphenyl)propyl]morpholine-2-carboxamide
CID 119782789

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-3-methyl-1-(2-methylphenyl)butyl]-2-[(2S)-morpholin-2-yl]acetamide?
The IUPAC name of N-[(1S)-3-methyl-1-(2-methylphenyl)butyl]-2-[(2S)-morpholin-2-yl]acetamide (CID 129393193) is N-[(1S)-3-methyl-1-(2-methylphenyl)butyl]-2-[(2S)-morpholin-2-yl]acetamide.
What is the SMILES notation for N-[(1S)-3-methyl-1-(2-methylphenyl)butyl]-2-[(2S)-morpholin-2-yl]acetamide?
The canonical SMILES for N-[(1S)-3-methyl-1-(2-methylphenyl)butyl]-2-[(2S)-morpholin-2-yl]acetamide is Cc1ccccc1[C@H](CC(C)C)NC(=O)C[C@H]1CNCCO1.
What is the InChIKey of N-[(1S)-3-methyl-1-(2-methylphenyl)butyl]-2-[(2S)-morpholin-2-yl]acetamide?
The InChIKey is YUIHUEQYQIUGRQ-RDJZCZTQSA-N. The full InChI is InChI=1S/C18H28N2O2/c1-13(2)10-17(16-7-5-4-6-14(16)3)20-18(21)11-15-12-19-8-9-22-15/h4-7,13,15,17,19H,8-12H2,1-3H3,(H,20,21)/t15-,17-/m0/s1.
What are the key properties of N-[(1S)-3-methyl-1-(2-methylphenyl)butyl]-2-[(2S)-morpholin-2-yl]acetamide?
N-[(1S)-3-methyl-1-(2-methylphenyl)butyl]-2-[(2S)-morpholin-2-yl]acetamide has a molecular weight of 304.43 g/mol, XLogP of 2.58, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-3-methyl-1-(2-methylphenyl)butyl]-2-[(2S)-morpholin-2-yl]acetamide is sourced from PubChem (CID 129393193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).