molecular hydrogen;N-(2-propoxyethyl)propanamide

C8H19NO2 — CID 170639851

IUPACmolecular hydrogen;N-(2-propoxyethyl)propanamide
SMILESCCCOCCNC(=O)CC.[H][H]
InChIInChI=1S/C8H17NO2.H2/c1-3-6-11-7-5-9-8(10)4-2;/h3-7H2,1-2H3,(H,9,10);1H
InChIKeyFRCCWRRNVNHOHF-UHFFFAOYSA-N
MW161.25 g/mol
LogP1.19
Rot. Bonds6

About molecular hydrogen;N-(2-propoxyethyl)propanamide

molecular hydrogen;N-(2-propoxyethyl)propanamide (PubChem CID 170639851) has the molecular formula C8H19NO2 and a molecular weight of 161.25 g/mol. Its IUPAC name is molecular hydrogen;N-(2-propoxyethyl)propanamide.

Molecular Properties

Compound Namemolecular hydrogen;N-(2-propoxyethyl)propanamide
PubChem CID170639851
Molecular FormulaC8H19NO2
Molecular Weight161.25 g/mol
Exact Mass161.14
IUPAC Namemolecular hydrogen;N-(2-propoxyethyl)propanamide
SMILESCCCOCCNC(=O)CC.[H][H]
InChIInChI=1S/C8H17NO2.H2/c1-3-6-11-7-5-9-8(10)4-2;/h3-7H2,1-2H3,(H,9,10);1H
InChIKeyFRCCWRRNVNHOHF-UHFFFAOYSA-N
XLogP1.19
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze molecular hydrogen;N-(2-propoxyethyl)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-(2-butoxyethoxy)ethyl]propanamide
CID 153105198
N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]propanamide
CID 122664379
ethane;molecular hydrogen;N-[2-(2-propoxyethoxy)ethyl]pentanamide
CID 170639867
N-[2-(2-propoxyethoxy)ethyl]butanamide
CID 88853938
ethane;[2-oxo-2-(2-propoxyethylamino)ethyl]mercury
CID 171823735
2-bromo-N-[2-[2-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide
CID 90995903
N-[2-(2-heptoxyethoxy)ethyl]propanamide
CID 154643004
N-[2-[2-[2-[2-(propanoylamino)ethoxy]ethoxy]ethoxy]ethyl]pentanamide
CID 167513156
N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-3-(2-propoxyethoxy)propanamide;molecular hydrogen
CID 176987409
N-[2-(3-oxobutoxy)ethyl]propanamide
CID 170259518
N-[2-[2-[(2-methoxyacetyl)amino]ethoxy]ethyl]propanamide
CID 118258329
N-[2-[2-[2-(ethylamino)ethoxy]ethoxy]ethyl]propanamide
CID 147425516

Frequently Asked Questions

What is the IUPAC name of molecular hydrogen;N-(2-propoxyethyl)propanamide?
The IUPAC name of molecular hydrogen;N-(2-propoxyethyl)propanamide (CID 170639851) is molecular hydrogen;N-(2-propoxyethyl)propanamide.
What is the SMILES notation for molecular hydrogen;N-(2-propoxyethyl)propanamide?
The canonical SMILES for molecular hydrogen;N-(2-propoxyethyl)propanamide is CCCOCCNC(=O)CC.[H][H].
What is the InChIKey of molecular hydrogen;N-(2-propoxyethyl)propanamide?
The InChIKey is FRCCWRRNVNHOHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2.H2/c1-3-6-11-7-5-9-8(10)4-2;/h3-7H2,1-2H3,(H,9,10);1H.
What are the key properties of molecular hydrogen;N-(2-propoxyethyl)propanamide?
molecular hydrogen;N-(2-propoxyethyl)propanamide has a molecular weight of 161.25 g/mol, XLogP of 1.19, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for molecular hydrogen;N-(2-propoxyethyl)propanamide is sourced from PubChem (CID 170639851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).