N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]-1-propylazetidine-3-carboxamide;molecular hydrogen

C15H32N2O4 — CID 154672359

IUPACN-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]-1-propylazetidine-3-carboxamide;molecular hydrogen
SMILESCCCN1CC(C(=O)NCCOCCOCCOCC)C1.[H][H]
InChIInChI=1S/C15H30N2O4.H2/c1-3-6-17-12-14(13-17)15(18)16-5-7-20-10-11-21-9-8-19-4-2;/h14H,3-13H2,1-2H3,(H,16,18);1H
InChIKeyHTCTUKADTGRLTA-UHFFFAOYSA-N
MW304.43 g/mol
LogP0.76
Rot. Bonds13

About N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]-1-propylazetidine-3-carboxamide;molecular hydrogen

N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]-1-propylazetidine-3-carboxamide;molecular hydrogen (PubChem CID 154672359) has the molecular formula C15H32N2O4 and a molecular weight of 304.43 g/mol. Its IUPAC name is N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]-1-propylazetidine-3-carboxamide;molecular hydrogen.

Molecular Properties

Compound NameN-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]-1-propylazetidine-3-carboxamide;molecular hydrogen
PubChem CID154672359
Molecular FormulaC15H32N2O4
Molecular Weight304.43 g/mol
Exact Mass304.24
IUPAC NameN-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]-1-propylazetidine-3-carboxamide;molecular hydrogen
SMILESCCCN1CC(C(=O)NCCOCCOCCOCC)C1.[H][H]
InChIInChI=1S/C15H30N2O4.H2/c1-3-6-17-12-14(13-17)15(18)16-5-7-20-10-11-21-9-8-19-4-2;/h14H,3-13H2,1-2H3,(H,16,18);1H
InChIKeyHTCTUKADTGRLTA-UHFFFAOYSA-N
XLogP0.76
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds13
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.43
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

ethane;N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-4-methylcyclohexane-1-carboxamide
CID 177357452
1-(4-acetylcyclohexyl)-N-[2-(2-ethoxyethoxy)ethyl]azetidine-3-carboxamide
CID 169159325
N-(2-ethoxyethyl)azetidine-3-carboxamide;hydrochloride
CID 142434678
N-(2-aminoethyl)-1-(2-ethoxyethyl)piperidine-3-carboxamide
CID 63252840
N-(2-butoxyethyl)-1-ethylpiperidine-4-carboxamide
CID 176985091
(3R)-N-(3-ethoxypropyl)-1-methylpiperidine-3-carboxamide
CID 99970155
1,4-di(hexadecanoyl)-N-[2-[2-(3-oxobutoxy)ethoxy]ethyl]-1,4-diazepane-6-carboxamide
CID 170630613
tert-butyl N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]carbamate;molecular hydrogen
CID 177223683
N-(3-ethoxypropyl)-1-(3-hydroxypropyl)piperidine-4-carboxamide
CID 60500354
N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]propanamide
CID 122664379
N-[2-(2-methoxyethoxy)ethyl]-1-propylsulfonylpiperidine-3-carboxamide
CID 55685553
(3S)-1-butyl-N-(3-ethoxypropyl)-5-oxopyrrolidine-3-carboxamide
CID 9399516

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]-1-propylazetidine-3-carboxamide;molecular hydrogen?
The IUPAC name of N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]-1-propylazetidine-3-carboxamide;molecular hydrogen (CID 154672359) is N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]-1-propylazetidine-3-carboxamide;molecular hydrogen.
What is the SMILES notation for N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]-1-propylazetidine-3-carboxamide;molecular hydrogen?
The canonical SMILES for N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]-1-propylazetidine-3-carboxamide;molecular hydrogen is CCCN1CC(C(=O)NCCOCCOCCOCC)C1.[H][H].
What is the InChIKey of N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]-1-propylazetidine-3-carboxamide;molecular hydrogen?
The InChIKey is HTCTUKADTGRLTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O4.H2/c1-3-6-17-12-14(13-17)15(18)16-5-7-20-10-11-21-9-8-19-4-2;/h14H,3-13H2,1-2H3,(H,16,18);1H.
What are the key properties of N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]-1-propylazetidine-3-carboxamide;molecular hydrogen?
N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]-1-propylazetidine-3-carboxamide;molecular hydrogen has a molecular weight of 304.43 g/mol, XLogP of 0.76, 13 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]-1-propylazetidine-3-carboxamide;molecular hydrogen is sourced from PubChem (CID 154672359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).