N-[2-[bis(2-acetamidoethoxy)methoxy]ethyl]prop-2-enamide

C14H25N3O6 — CID 140637156

IUPACN-[2-[bis(2-acetamidoethoxy)methoxy]ethyl]prop-2-enamide
SMILESC=CC(=O)NCCOC(OCCNC(C)=O)OCCNC(C)=O
InChIInChI=1S/C14H25N3O6/c1-4-13(20)17-7-10-23-14(21-8-5-15-11(2)18)22-9-6-16-12(3)19/h4,14H,1,5-10H2,2-3H3,(H,15,18)(H,16,19)(H,17,20)
InChIKeyQZTKDVQDNGDJAK-UHFFFAOYSA-N
MW331.37 g/mol
LogP-1.11
Rot. Bonds13

About N-[2-[bis(2-acetamidoethoxy)methoxy]ethyl]prop-2-enamide

N-[2-[bis(2-acetamidoethoxy)methoxy]ethyl]prop-2-enamide (PubChem CID 140637156) has the molecular formula C14H25N3O6 and a molecular weight of 331.37 g/mol. Its IUPAC name is N-[2-[bis(2-acetamidoethoxy)methoxy]ethyl]prop-2-enamide.

Molecular Properties

Compound NameN-[2-[bis(2-acetamidoethoxy)methoxy]ethyl]prop-2-enamide
PubChem CID140637156
Molecular FormulaC14H25N3O6
Molecular Weight331.37 g/mol
Exact Mass331.17
IUPAC NameN-[2-[bis(2-acetamidoethoxy)methoxy]ethyl]prop-2-enamide
SMILESC=CC(=O)NCCOC(OCCNC(C)=O)OCCNC(C)=O
InChIInChI=1S/C14H25N3O6/c1-4-13(20)17-7-10-23-14(21-8-5-15-11(2)18)22-9-6-16-12(3)19/h4,14H,1,5-10H2,2-3H3,(H,15,18)(H,16,19)(H,17,20)
InChIKeyQZTKDVQDNGDJAK-UHFFFAOYSA-N
XLogP-1.11
TPSA114.99 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.37
LogP ≤ 5-1.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze N-[2-[bis(2-acetamidoethoxy)methoxy]ethyl]prop-2-enamide 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-Dimethoxyethyl)-2-propenamide
CID 9898899
N-(2-ethoxy-1,3-dioxan-5-yl)prop-2-enamide
CID 102279284
N-(2-(1-(allyloxy)ethoxy)ethyl)acrylamide
CID 132577956
N-(1,2,2-Triethoxyethyl)prop-2-enamide
CID 13982976
N,N'-bisacryloyl-2,2-di-(2-aminoethoxy)propane
CID 15608862
Acrylamidobutyraldehyde Dimethyl Acetal
CID 18520795
N-(1,2,2-Trimethoxyethyl)-2-propenamide
CID 18690231
[1-Acetyloxy-2-(prop-2-enoylamino)butyl] acetate
CID 19376135
N-(1,1-dipropoxybutan-2-yl)prop-2-enamide
CID 19376153
N-(2,2-dipentoxyethyl)prop-2-enamide
CID 19746540
N-(2-methoxyethyl)prop-2-enamide;bis(propan-2-one)
CID 19756748
2-(Prop-2-enoylamino)ethyl prop-2-ynyl carbonate
CID 19774716

Frequently Asked Questions

What is the IUPAC name of N-[2-[bis(2-acetamidoethoxy)methoxy]ethyl]prop-2-enamide?
The IUPAC name of N-[2-[bis(2-acetamidoethoxy)methoxy]ethyl]prop-2-enamide (CID 140637156) is N-[2-[bis(2-acetamidoethoxy)methoxy]ethyl]prop-2-enamide.
What is the SMILES notation for N-[2-[bis(2-acetamidoethoxy)methoxy]ethyl]prop-2-enamide?
The canonical SMILES for N-[2-[bis(2-acetamidoethoxy)methoxy]ethyl]prop-2-enamide is C=CC(=O)NCCOC(OCCNC(C)=O)OCCNC(C)=O.
What is the InChIKey of N-[2-[bis(2-acetamidoethoxy)methoxy]ethyl]prop-2-enamide?
The InChIKey is QZTKDVQDNGDJAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O6/c1-4-13(20)17-7-10-23-14(21-8-5-15-11(2)18)22-9-6-16-12(3)19/h4,14H,1,5-10H2,2-3H3,(H,15,18)(H,16,19)(H,17,20).
What are the key properties of N-[2-[bis(2-acetamidoethoxy)methoxy]ethyl]prop-2-enamide?
N-[2-[bis(2-acetamidoethoxy)methoxy]ethyl]prop-2-enamide has a molecular weight of 331.37 g/mol, XLogP of -1.11, 13 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[bis(2-acetamidoethoxy)methoxy]ethyl]prop-2-enamide is sourced from PubChem (CID 140637156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).