2,2-dimethyl-N-[2-[2-[2-[2-(prop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl]propanamide

C16H30N2O5 — CID 118332482

IUPAC2,2-dimethyl-N-[2-[2-[2-[2-(prop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl]propanamide
SMILESC=CC(=O)NCCOCCOCCOCCNC(=O)C(C)(C)C
InChIInChI=1S/C16H30N2O5/c1-5-14(19)17-6-8-21-10-12-23-13-11-22-9-7-18-15(20)16(2,3)4/h5H,1,6-13H2,2-4H3,(H,17,19)(H,18,20)
InChIKeyWJRPFUODAWKRQI-UHFFFAOYSA-N
MW330.43 g/mol
LogP0.50
Rot. Bonds13

About 2,2-dimethyl-N-[2-[2-[2-[2-(prop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl]propanamide

2,2-dimethyl-N-[2-[2-[2-[2-(prop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl]propanamide (PubChem CID 118332482) has the molecular formula C16H30N2O5 and a molecular weight of 330.43 g/mol. Its IUPAC name is 2,2-dimethyl-N-[2-[2-[2-[2-(prop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[2-[2-[2-[2-(prop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl]propanamide
PubChem CID118332482
Molecular FormulaC16H30N2O5
Molecular Weight330.43 g/mol
Exact Mass330.22
IUPAC Name2,2-dimethyl-N-[2-[2-[2-[2-(prop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl]propanamide
SMILESC=CC(=O)NCCOCCOCCOCCNC(=O)C(C)(C)C
InChIInChI=1S/C16H30N2O5/c1-5-14(19)17-6-8-21-10-12-23-13-11-22-9-7-18-15(20)16(2,3)4/h5H,1,6-13H2,2-4H3,(H,17,19)(H,18,20)
InChIKeyWJRPFUODAWKRQI-UHFFFAOYSA-N
XLogP0.50
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds13
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

N,N'-((ethane-1,2-diylbis(oxy))bis(ethane-2,1-diyl))diacrylamide
CID 42636032
N,n'-diacryloyl-4,7,10-trioxa-1,13-tridecanediamine
CID 11500839
N-[2-(2-methoxyethoxy)ethyl]acrylamide
CID 61849582
N-(2-(2-(2-aminoethoxy)ethoxy)ethyl)acrylamide
CID 89746615
N-(2-(2-(2-(2-azidoethoxy)ethoxy)ethoxy)ethyl) methacrylamide
CID 166176636
N-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethyl]prop-2-enamide
CID 91317844
N-(17-amino-3,6,9,12,15-pentaoxaheptadecyl)acrylamide
CID 172914434
N-(17-azido-3,6,9,12,15-pentaoxaheptadecyl)acrylamide
CID 172914462
2-[2-[2-[2-(prop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl N-methylcarbamate
CID 176433411
N-[2-(2-methoxyethoxy)ethyl]-2-methylprop-2-enamide
CID 15332975
2-methyl-N-[3-[2-[3-(2-methylprop-2-enoylamino)propoxy]ethoxy]propyl]prop-2-enamide
CID 18984254
2-methyl-N-[2-[2-(2-methylprop-2-enoylamino)ethoxy]ethyl]prop-2-enamide
CID 23396054

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[2-[2-[2-[2-(prop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[2-[2-[2-[2-(prop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl]propanamide (CID 118332482) is 2,2-dimethyl-N-[2-[2-[2-[2-(prop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[2-[2-[2-[2-(prop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[2-[2-[2-[2-(prop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl]propanamide is C=CC(=O)NCCOCCOCCOCCNC(=O)C(C)(C)C.
What is the InChIKey of 2,2-dimethyl-N-[2-[2-[2-[2-(prop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl]propanamide?
The InChIKey is WJRPFUODAWKRQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O5/c1-5-14(19)17-6-8-21-10-12-23-13-11-22-9-7-18-15(20)16(2,3)4/h5H,1,6-13H2,2-4H3,(H,17,19)(H,18,20).
What are the key properties of 2,2-dimethyl-N-[2-[2-[2-[2-(prop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl]propanamide?
2,2-dimethyl-N-[2-[2-[2-[2-(prop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl]propanamide has a molecular weight of 330.43 g/mol, XLogP of 0.50, 13 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[2-[2-[2-[2-(prop-2-enoylamino)ethoxy]ethoxy]ethoxy]ethyl]propanamide is sourced from PubChem (CID 118332482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).