3-[2-(2-methoxyethoxy)ethyl-methylamino]-N-(1-phenylpropyl)propanamide

C18H30N2O3 — CID 126826291

IUPAC3-[2-(2-methoxyethoxy)ethyl-methylamino]-N-(1-phenylpropyl)propanamide
SMILESCCC(NC(=O)CCN(C)CCOCCOC)c1ccccc1
InChIInChI=1S/C18H30N2O3/c1-4-17(16-8-6-5-7-9-16)19-18(21)10-11-20(2)12-13-23-15-14-22-3/h5-9,17H,4,10-15H2,1-3H3,(H,19,21)
InChIKeyKSFFAEHNKOZZFG-UHFFFAOYSA-N
MW322.45 g/mol
LogP2.24
Rot. Bonds12

About 3-[2-(2-methoxyethoxy)ethyl-methylamino]-N-(1-phenylpropyl)propanamide

3-[2-(2-methoxyethoxy)ethyl-methylamino]-N-(1-phenylpropyl)propanamide (PubChem CID 126826291) has the molecular formula C18H30N2O3 and a molecular weight of 322.45 g/mol. Its IUPAC name is 3-[2-(2-methoxyethoxy)ethyl-methylamino]-N-(1-phenylpropyl)propanamide.

Molecular Properties

Compound Name3-[2-(2-methoxyethoxy)ethyl-methylamino]-N-(1-phenylpropyl)propanamide
PubChem CID126826291
Molecular FormulaC18H30N2O3
Molecular Weight322.45 g/mol
Exact Mass322.23
IUPAC Name3-[2-(2-methoxyethoxy)ethyl-methylamino]-N-(1-phenylpropyl)propanamide
SMILESCCC(NC(=O)CCN(C)CCOCCOC)c1ccccc1
InChIInChI=1S/C18H30N2O3/c1-4-17(16-8-6-5-7-9-16)19-18(21)10-11-20(2)12-13-23-15-14-22-3/h5-9,17H,4,10-15H2,1-3H3,(H,19,21)
InChIKeyKSFFAEHNKOZZFG-UHFFFAOYSA-N
XLogP2.24
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.45
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-methoxyethoxy)-N-(1-phenylpropyl)acetamide
CID 103612351
3-[[2-(2-methoxyethoxy)acetyl]amino]-3-phenylpropanoic acid
CID 43358425
4-amino-N-(1-phenylpropyl)butanamide
CID 62305395
N-[(1S)-2-hydroxy-1-phenylethyl]-5-methoxypentanamide
CID 110001835
2-[4-(2-methoxyethoxy)anilino]-N-(1-phenylpropyl)acetamide
CID 54822434
2-methyl-N-[2-oxo-2-[[(1S)-1-phenylpropyl]amino]ethyl]benzamide
CID 95763013
3-(4-methylphenyl)sulfanyl-N-[(1R)-1-phenylpropyl]propanamide
CID 94027994
3-(4-tert-butylphenyl)-N-[(1R)-1-phenylpropyl]propanamide
CID 99951707
3-(2-methoxyethoxy)-N-[1-(5-phenyl-1H-imidazol-2-yl)propyl]propanamide
CID 51099230
3-(2-methoxyethoxy)-N-[(1R)-1-(5-phenyl-1H-imidazol-2-yl)propyl]propanamide
CID 94821044
1-N,4-N-bis(1-phenylpropyl)benzene-1,4-dicarboxamide
CID 43912072
3-(4-methylphenyl)-N-[(1R)-1-phenylpropyl]propanamide
CID 92675135

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-methoxyethoxy)ethyl-methylamino]-N-(1-phenylpropyl)propanamide?
The IUPAC name of 3-[2-(2-methoxyethoxy)ethyl-methylamino]-N-(1-phenylpropyl)propanamide (CID 126826291) is 3-[2-(2-methoxyethoxy)ethyl-methylamino]-N-(1-phenylpropyl)propanamide.
What is the SMILES notation for 3-[2-(2-methoxyethoxy)ethyl-methylamino]-N-(1-phenylpropyl)propanamide?
The canonical SMILES for 3-[2-(2-methoxyethoxy)ethyl-methylamino]-N-(1-phenylpropyl)propanamide is CCC(NC(=O)CCN(C)CCOCCOC)c1ccccc1.
What is the InChIKey of 3-[2-(2-methoxyethoxy)ethyl-methylamino]-N-(1-phenylpropyl)propanamide?
The InChIKey is KSFFAEHNKOZZFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O3/c1-4-17(16-8-6-5-7-9-16)19-18(21)10-11-20(2)12-13-23-15-14-22-3/h5-9,17H,4,10-15H2,1-3H3,(H,19,21).
What are the key properties of 3-[2-(2-methoxyethoxy)ethyl-methylamino]-N-(1-phenylpropyl)propanamide?
3-[2-(2-methoxyethoxy)ethyl-methylamino]-N-(1-phenylpropyl)propanamide has a molecular weight of 322.45 g/mol, XLogP of 2.24, 12 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-methoxyethoxy)ethyl-methylamino]-N-(1-phenylpropyl)propanamide is sourced from PubChem (CID 126826291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).