2-[2-ethoxyethoxy(propan-2-yl)amino]ethyl carbamate

C10H22N2O4 — CID 88718591

IUPAC2-[2-ethoxyethoxy(propan-2-yl)amino]ethyl carbamate
SMILESCCOCCON(CCOC(N)=O)C(C)C
InChIInChI=1S/C10H22N2O4/c1-4-14-7-8-16-12(9(2)3)5-6-15-10(11)13/h9H,4-8H2,1-3H3,(H2,11,13)
InChIKeyABUGZYJVMCXTOH-UHFFFAOYSA-N
MW234.30 g/mol
LogP0.76
Rot. Bonds9

About 2-[2-ethoxyethoxy(propan-2-yl)amino]ethyl carbamate

2-[2-ethoxyethoxy(propan-2-yl)amino]ethyl carbamate (PubChem CID 88718591) has the molecular formula C10H22N2O4 and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-[2-ethoxyethoxy(propan-2-yl)amino]ethyl carbamate.

Molecular Properties

Compound Name2-[2-ethoxyethoxy(propan-2-yl)amino]ethyl carbamate
PubChem CID88718591
Molecular FormulaC10H22N2O4
Molecular Weight234.30 g/mol
Exact Mass234.16
IUPAC Name2-[2-ethoxyethoxy(propan-2-yl)amino]ethyl carbamate
SMILESCCOCCON(CCOC(N)=O)C(C)C
InChIInChI=1S/C10H22N2O4/c1-4-14-7-8-16-12(9(2)3)5-6-15-10(11)13/h9H,4-8H2,1-3H3,(H2,11,13)
InChIKeyABUGZYJVMCXTOH-UHFFFAOYSA-N
XLogP0.76
TPSA74.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-[2-ethoxyethoxy(propan-2-yl)amino]ethyl carbamate 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

3-[di(propan-2-yl)amino]propyl carbamate
CID 175431360
2-ethoxyethyl 3,4-dimethylpentanoate
CID 142740065
ethyl 3-[bis(2-ethoxyethyl)amino]butanoate
CID 82951064
2-[2-(2-propoxyethoxy)ethoxy]ethyl carbamate
CID 177163981
bis(3-ethoxypropyl) 2-methylpropanedioate
CID 101278684
2-(2-ethoxyethoxy)ethyl (2S)-2-aminopropanoate
CID 167342621
2-ethoxyethyl (2R)-2-methylbutanoate
CID 59033497
3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanamide
CID 89154469
ethyl 3-carbamoyloxypropanoate
CID 175485814
diethyl 2-[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]propanedioate
CID 25178903
2-ethoxyethyl 2-amino-3-methylbutanoate
CID 61276999
2-(2-ethoxyethoxy)ethyl 3-methylbutanoate
CID 91696182

Frequently Asked Questions

What is the IUPAC name of 2-[2-ethoxyethoxy(propan-2-yl)amino]ethyl carbamate?
The IUPAC name of 2-[2-ethoxyethoxy(propan-2-yl)amino]ethyl carbamate (CID 88718591) is 2-[2-ethoxyethoxy(propan-2-yl)amino]ethyl carbamate.
What is the SMILES notation for 2-[2-ethoxyethoxy(propan-2-yl)amino]ethyl carbamate?
The canonical SMILES for 2-[2-ethoxyethoxy(propan-2-yl)amino]ethyl carbamate is CCOCCON(CCOC(N)=O)C(C)C.
What is the InChIKey of 2-[2-ethoxyethoxy(propan-2-yl)amino]ethyl carbamate?
The InChIKey is ABUGZYJVMCXTOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O4/c1-4-14-7-8-16-12(9(2)3)5-6-15-10(11)13/h9H,4-8H2,1-3H3,(H2,11,13).
What are the key properties of 2-[2-ethoxyethoxy(propan-2-yl)amino]ethyl carbamate?
2-[2-ethoxyethoxy(propan-2-yl)amino]ethyl carbamate has a molecular weight of 234.30 g/mol, XLogP of 0.76, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-ethoxyethoxy(propan-2-yl)amino]ethyl carbamate is sourced from PubChem (CID 88718591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).