2-acetamido-N-(2-methylpropoxy)propanamide

C9H18N2O3 — CID 115409958

IUPAC2-acetamido-N-(2-methylpropoxy)propanamide
SMILESCC(=O)NC(C)C(=O)NOCC(C)C
InChIInChI=1S/C9H18N2O3/c1-6(2)5-14-11-9(13)7(3)10-8(4)12/h6-7H,5H2,1-4H3,(H,10,12)(H,11,13)
InChIKeyVAAKHCKEVHDHEV-UHFFFAOYSA-N
MW202.25 g/mol
LogP0.21
Rot. Bonds5

About 2-acetamido-N-(2-methylpropoxy)propanamide

2-acetamido-N-(2-methylpropoxy)propanamide (PubChem CID 115409958) has the molecular formula C9H18N2O3 and a molecular weight of 202.25 g/mol. Its IUPAC name is 2-acetamido-N-(2-methylpropoxy)propanamide.

Molecular Properties

Compound Name2-acetamido-N-(2-methylpropoxy)propanamide
PubChem CID115409958
Molecular FormulaC9H18N2O3
Molecular Weight202.25 g/mol
Exact Mass202.13
IUPAC Name2-acetamido-N-(2-methylpropoxy)propanamide
SMILESCC(=O)NC(C)C(=O)NOCC(C)C
InChIInChI=1S/C9H18N2O3/c1-6(2)5-14-11-9(13)7(3)10-8(4)12/h6-7H,5H2,1-4H3,(H,10,12)(H,11,13)
InChIKeyVAAKHCKEVHDHEV-UHFFFAOYSA-N
XLogP0.21
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-(2-methylpropoxy)propanamide
CID 82721936
2-acetamido-N-[1-(methoxyamino)-1-oxopropan-2-yl]propanamide
CID 20680961
3-chloro-2-methyl-N-(2-methylpropoxy)propanamide
CID 82715896
(2R)-2-acetamido-N-(2-phenylethoxy)propanamide
CID 87633799
methyl (2R)-2-[[(2R)-2-[[(2R)-2-acetamidopropanoyl]amino]propanoyl]amino]propanoate
CID 36688580
2-acetamido-N-(4-methylpentyl)propanamide
CID 134023295
methyl (2R)-2-acetamidopropanoate
CID 6951031
ethyl (2S)-2-acetamidopropanoate
CID 11805045
N-(2-methylpropoxy)-2-phenoxypropanamide
CID 113304383
2,2-di(cyclobutyl)-N-(2-methylpropoxy)acetamide
CID 112745042
ethyl (2R)-2-[[(2S)-2-acetamidopropanoyl]amino]-3-methylbutanoate
CID 175974322
2-(4-methoxyphenoxy)-N-(2-methylpropoxy)propanamide
CID 115409892

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-(2-methylpropoxy)propanamide?
The IUPAC name of 2-acetamido-N-(2-methylpropoxy)propanamide (CID 115409958) is 2-acetamido-N-(2-methylpropoxy)propanamide.
What is the SMILES notation for 2-acetamido-N-(2-methylpropoxy)propanamide?
The canonical SMILES for 2-acetamido-N-(2-methylpropoxy)propanamide is CC(=O)NC(C)C(=O)NOCC(C)C.
What is the InChIKey of 2-acetamido-N-(2-methylpropoxy)propanamide?
The InChIKey is VAAKHCKEVHDHEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O3/c1-6(2)5-14-11-9(13)7(3)10-8(4)12/h6-7H,5H2,1-4H3,(H,10,12)(H,11,13).
What are the key properties of 2-acetamido-N-(2-methylpropoxy)propanamide?
2-acetamido-N-(2-methylpropoxy)propanamide has a molecular weight of 202.25 g/mol, XLogP of 0.21, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-(2-methylpropoxy)propanamide is sourced from PubChem (CID 115409958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).