N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-3-(2-propoxyethoxy)propanamide;molecular hydrogen

C18H39NO6 — CID 176987409

IUPACN-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-3-(2-propoxyethoxy)propanamide;molecular hydrogen
SMILESCCCCOCCOCCOCCNC(=O)CCOCCOCCC.[H][H]
InChIInChI=1S/C18H37NO6.H2/c1-3-5-9-22-13-16-25-17-15-24-11-7-19-18(20)6-10-23-14-12-21-8-4-2;/h3-17H2,1-2H3,(H,19,20);1H
InChIKeyHGWZSSBVZLSTAN-UHFFFAOYSA-N
MW365.51 g/mol
LogP2.03
Rot. Bonds20

About N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-3-(2-propoxyethoxy)propanamide;molecular hydrogen

N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-3-(2-propoxyethoxy)propanamide;molecular hydrogen (PubChem CID 176987409) has the molecular formula C18H39NO6 and a molecular weight of 365.51 g/mol. Its IUPAC name is N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-3-(2-propoxyethoxy)propanamide;molecular hydrogen.

Molecular Properties

Compound NameN-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-3-(2-propoxyethoxy)propanamide;molecular hydrogen
PubChem CID176987409
Molecular FormulaC18H39NO6
Molecular Weight365.51 g/mol
Exact Mass365.28
IUPAC NameN-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-3-(2-propoxyethoxy)propanamide;molecular hydrogen
SMILESCCCCOCCOCCOCCNC(=O)CCOCCOCCC.[H][H]
InChIInChI=1S/C18H37NO6.H2/c1-3-5-9-22-13-16-25-17-15-24-11-7-19-18(20)6-10-23-14-12-21-8-4-2;/h3-17H2,1-2H3,(H,19,20);1H
InChIKeyHGWZSSBVZLSTAN-UHFFFAOYSA-N
XLogP2.03
TPSA75.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds20
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.51
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-3-(2-propoxyethoxy)propanamide;molecular hydrogen 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

ethane;molecular hydrogen;N-[2-(2-propoxyethoxy)ethyl]pentanamide
CID 170639867
3-(2-propoxyethoxy)-N-propylpropanamide
CID 163586322
N-[2-(2-propoxyethoxy)ethyl]butanamide
CID 88853938
N-[2-(2-butoxyethoxy)ethyl]propanamide
CID 153105198
3-[2-[2-[2-[3-[3-[3-[2-[2-[2-(2-carboxyethoxy)ethoxy]ethoxy]ethylamino]-3-oxopropoxy]propoxy]propanoylamino]ethoxy]ethoxy]ethoxy]propanoic acid
CID 123748562
ethane;3-propoxy-N-propylpropanamide
CID 163269237
molecular hydrogen;N-(2-propoxyethyl)propanamide
CID 170639851
N-methyl-N'-[2-(2-propoxyethoxy)ethyl]pentanediamide
CID 176584959
16-oxo-16-(2-propoxyethylamino)hexadecanoic acid
CID 122592174
4-amino-N-[2-[2-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]butanamide
CID 145188206
molecular hydrogen;N-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethyl]-3-[2-[[2-[2-(2-propoxyethoxy)ethoxy]acetyl]amino]ethoxy]propanamide
CID 176953270
N-ethyl-3-[2-(2-propoxyethoxy)ethoxy]propanamide
CID 144855445

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-3-(2-propoxyethoxy)propanamide;molecular hydrogen?
The IUPAC name of N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-3-(2-propoxyethoxy)propanamide;molecular hydrogen (CID 176987409) is N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-3-(2-propoxyethoxy)propanamide;molecular hydrogen.
What is the SMILES notation for N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-3-(2-propoxyethoxy)propanamide;molecular hydrogen?
The canonical SMILES for N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-3-(2-propoxyethoxy)propanamide;molecular hydrogen is CCCCOCCOCCOCCNC(=O)CCOCCOCCC.[H][H].
What is the InChIKey of N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-3-(2-propoxyethoxy)propanamide;molecular hydrogen?
The InChIKey is HGWZSSBVZLSTAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37NO6.H2/c1-3-5-9-22-13-16-25-17-15-24-11-7-19-18(20)6-10-23-14-12-21-8-4-2;/h3-17H2,1-2H3,(H,19,20);1H.
What are the key properties of N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-3-(2-propoxyethoxy)propanamide;molecular hydrogen?
N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-3-(2-propoxyethoxy)propanamide;molecular hydrogen has a molecular weight of 365.51 g/mol, XLogP of 2.03, 20 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-3-(2-propoxyethoxy)propanamide;molecular hydrogen is sourced from PubChem (CID 176987409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).