methane;3-methoxy-N-(3-oxopropyl)propanamide

C9H21NO3 — CID 160698197

IUPACmethane;3-methoxy-N-(3-oxopropyl)propanamide
SMILESC.C.COCCC(=O)NCCC=O
InChIInChI=1S/C7H13NO3.2CH4/c1-11-6-3-7(10)8-4-2-5-9;;/h5H,2-4,6H2,1H3,(H,8,10);2*1H4
InChIKeyRQGPDZSRJAPEST-UHFFFAOYSA-N
MW191.27 g/mol
LogP1.00
Rot. Bonds6

About methane;3-methoxy-N-(3-oxopropyl)propanamide

methane;3-methoxy-N-(3-oxopropyl)propanamide (PubChem CID 160698197) has the molecular formula C9H21NO3 and a molecular weight of 191.27 g/mol. Its IUPAC name is methane;3-methoxy-N-(3-oxopropyl)propanamide.

Molecular Properties

Compound Namemethane;3-methoxy-N-(3-oxopropyl)propanamide
PubChem CID160698197
Molecular FormulaC9H21NO3
Molecular Weight191.27 g/mol
Exact Mass191.15
IUPAC Namemethane;3-methoxy-N-(3-oxopropyl)propanamide
SMILESC.C.COCCC(=O)NCCC=O
InChIInChI=1S/C7H13NO3.2CH4/c1-11-6-3-7(10)8-4-2-5-9;;/h5H,2-4,6H2,1H3,(H,8,10);2*1H4
InChIKeyRQGPDZSRJAPEST-UHFFFAOYSA-N
XLogP1.00
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze methane;3-methoxy-N-(3-oxopropyl)propanamide 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

N-[2-(ethylamino)ethyl]-3-methoxypropanamide
CID 62658774
N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-5-oxopentanamide
CID 162740366
3-methoxy-N-[2-[2-[2-(3-methoxypropanoylamino)ethoxy]ethoxy]ethyl]propanamide
CID 166969109
N-[2-(3-methoxypropanoylamino)ethyl]-3-methylbutanamide
CID 108538534
N-[2-(3-methoxypropanoylamino)ethyl]-3,3-dimethylbutanamide
CID 108574166
methane;3-methoxy-N-pentylpropanamide
CID 157319265
N,N'-bis(2-methoxyethyl)hexanediamide
CID 2933923
prop-2-enyl N-[2-(3-methoxypropanoylamino)ethyl]carbamate
CID 108574174
3-(dimethylamino)-N-(3-oxopropyl)propanamide
CID 142174059
N-(3-oxopropyl)octanamide
CID 163482929
N-[2-(ethylamino)ethyl]-3-(2-methoxyethoxy)propanamide
CID 119508820
5-methoxy-N-(2-methoxyethyl)pentanamide
CID 58281484

Frequently Asked Questions

What is the IUPAC name of methane;3-methoxy-N-(3-oxopropyl)propanamide?
The IUPAC name of methane;3-methoxy-N-(3-oxopropyl)propanamide (CID 160698197) is methane;3-methoxy-N-(3-oxopropyl)propanamide.
What is the SMILES notation for methane;3-methoxy-N-(3-oxopropyl)propanamide?
The canonical SMILES for methane;3-methoxy-N-(3-oxopropyl)propanamide is C.C.COCCC(=O)NCCC=O.
What is the InChIKey of methane;3-methoxy-N-(3-oxopropyl)propanamide?
The InChIKey is RQGPDZSRJAPEST-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO3.2CH4/c1-11-6-3-7(10)8-4-2-5-9;;/h5H,2-4,6H2,1H3,(H,8,10);2*1H4.
What are the key properties of methane;3-methoxy-N-(3-oxopropyl)propanamide?
methane;3-methoxy-N-(3-oxopropyl)propanamide has a molecular weight of 191.27 g/mol, XLogP of 1.00, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methane;3-methoxy-N-(3-oxopropyl)propanamide is sourced from PubChem (CID 160698197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).