2-(3-methoxypropylamino)-N-(4-propan-2-yloxyphenyl)acetamide

C15H24N2O3 — CID 54829052

IUPAC2-(3-methoxypropylamino)-N-(4-propan-2-yloxyphenyl)acetamide
SMILESCOCCCNCC(=O)Nc1ccc(OC(C)C)cc1
InChIInChI=1S/C15H24N2O3/c1-12(2)20-14-7-5-13(6-8-14)17-15(18)11-16-9-4-10-19-3/h5-8,12,16H,4,9-11H2,1-3H3,(H,17,18)
InChIKeyVGZLBELODDAMKF-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.04
Rot. Bonds9

About 2-(3-methoxypropylamino)-N-(4-propan-2-yloxyphenyl)acetamide

2-(3-methoxypropylamino)-N-(4-propan-2-yloxyphenyl)acetamide (PubChem CID 54829052) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 2-(3-methoxypropylamino)-N-(4-propan-2-yloxyphenyl)acetamide.

Molecular Properties

Compound Name2-(3-methoxypropylamino)-N-(4-propan-2-yloxyphenyl)acetamide
PubChem CID54829052
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name2-(3-methoxypropylamino)-N-(4-propan-2-yloxyphenyl)acetamide
SMILESCOCCCNCC(=O)Nc1ccc(OC(C)C)cc1
InChIInChI=1S/C15H24N2O3/c1-12(2)20-14-7-5-13(6-8-14)17-15(18)11-16-9-4-10-19-3/h5-8,12,16H,4,9-11H2,1-3H3,(H,17,18)
InChIKeyVGZLBELODDAMKF-UHFFFAOYSA-N
XLogP2.04
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3-methoxypropyl)-4-[[2-[(4-propan-2-yloxyphenyl)methylamino]acetyl]amino]benzamide
CID 54845211
N-[4-(difluoromethoxy)phenyl]-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119676558
N-(3-methoxypropyl)-4-[[2-(3-methoxypropylamino)acetyl]amino]benzamide
CID 54828874
N-(3-methoxypropyl)-3-[[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]amino]benzamide
CID 54842246
2-(2-methoxyethylamino)-N-(4-methoxyphenyl)acetamide
CID 28565585
N-(4-propan-2-yloxyphenyl)-2-(prop-2-ynylamino)acetamide
CID 79286722
2-[3-(2-methoxyethoxy)propylamino]-N-phenylacetamide
CID 103605722
2-(2-methoxyethylamino)-N-[4-(2-methylpropoxy)phenyl]acetamide
CID 54819703
N-(4-methoxyphenyl)-2-(2-propan-2-yloxyethylamino)acetamide
CID 104760150
2-(hexadecylamino)-N-[4-(2-methoxyethoxy)phenyl]acetamide
CID 54808989
N-[4-[[2-(2-methoxyethylamino)acetyl]amino]phenyl]-3-methylbutanamide
CID 54819837
N,N'-bis(4-propan-2-yloxyphenyl)butanediamide
CID 17340345

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxypropylamino)-N-(4-propan-2-yloxyphenyl)acetamide?
The IUPAC name of 2-(3-methoxypropylamino)-N-(4-propan-2-yloxyphenyl)acetamide (CID 54829052) is 2-(3-methoxypropylamino)-N-(4-propan-2-yloxyphenyl)acetamide.
What is the SMILES notation for 2-(3-methoxypropylamino)-N-(4-propan-2-yloxyphenyl)acetamide?
The canonical SMILES for 2-(3-methoxypropylamino)-N-(4-propan-2-yloxyphenyl)acetamide is COCCCNCC(=O)Nc1ccc(OC(C)C)cc1.
What is the InChIKey of 2-(3-methoxypropylamino)-N-(4-propan-2-yloxyphenyl)acetamide?
The InChIKey is VGZLBELODDAMKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-12(2)20-14-7-5-13(6-8-14)17-15(18)11-16-9-4-10-19-3/h5-8,12,16H,4,9-11H2,1-3H3,(H,17,18).
What are the key properties of 2-(3-methoxypropylamino)-N-(4-propan-2-yloxyphenyl)acetamide?
2-(3-methoxypropylamino)-N-(4-propan-2-yloxyphenyl)acetamide has a molecular weight of 280.37 g/mol, XLogP of 2.04, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxypropylamino)-N-(4-propan-2-yloxyphenyl)acetamide is sourced from PubChem (CID 54829052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).