2-methoxyethyl N,N-bis(2-formamidoethyl)carbamate

C10H19N3O5 — CID 89335039

IUPAC2-methoxyethyl N,N-bis(2-formamidoethyl)carbamate
SMILESCOCCOC(=O)N(CCNC=O)CCNC=O
InChIInChI=1S/C10H19N3O5/c1-17-6-7-18-10(16)13(4-2-11-8-14)5-3-12-9-15/h8-9H,2-7H2,1H3,(H,11,14)(H,12,15)
InChIKeyYHOPKYYZERUFOO-UHFFFAOYSA-N
MW261.28 g/mol
LogP-1.44
Rot. Bonds11

About 2-methoxyethyl N,N-bis(2-formamidoethyl)carbamate

2-methoxyethyl N,N-bis(2-formamidoethyl)carbamate (PubChem CID 89335039) has the molecular formula C10H19N3O5 and a molecular weight of 261.28 g/mol. Its IUPAC name is 2-methoxyethyl N,N-bis(2-formamidoethyl)carbamate.

Molecular Properties

Compound Name2-methoxyethyl N,N-bis(2-formamidoethyl)carbamate
PubChem CID89335039
Molecular FormulaC10H19N3O5
Molecular Weight261.28 g/mol
Exact Mass261.13
IUPAC Name2-methoxyethyl N,N-bis(2-formamidoethyl)carbamate
SMILESCOCCOC(=O)N(CCNC=O)CCNC=O
InChIInChI=1S/C10H19N3O5/c1-17-6-7-18-10(16)13(4-2-11-8-14)5-3-12-9-15/h8-9H,2-7H2,1H3,(H,11,14)(H,12,15)
InChIKeyYHOPKYYZERUFOO-UHFFFAOYSA-N
XLogP-1.44
TPSA96.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 5-1.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methoxyethyl)formamide;sulfuric acid
CID 161274600
tert-butyl N-ethyl-N-(2-formamidoethyl)carbamate
CID 177330267
methyl 2-[2-formamidoethyl-(2-tritioacetyl)amino]acetate
CID 135036818
2-methoxyethyl 2-(3-formamidopropanoylamino)acetate
CID 57278213
N-(3-hydroxy-4-methoxybutyl)formamide
CID 106243326
octyl N,N-di(nonyl)carbamate
CID 168918776
N-[4-[formyl(methoxy)amino]butyl]formamide
CID 87925198
2-[2-formamidoethyl(methyl)amino]acetic acid
CID 118297504
octyl N,N-di(undecyl)carbamate
CID 168918683
pentyl 2-[ethyl(2-methoxyethoxycarbonyl)amino]acetate
CID 91723541
octadecyl 2-[ethyl(2-methoxyethoxycarbonyl)amino]acetate
CID 91723550
ethyl N-(formamidomethyl)-N-hexylcarbamate
CID 54056143

Frequently Asked Questions

What is the IUPAC name of 2-methoxyethyl N,N-bis(2-formamidoethyl)carbamate?
The IUPAC name of 2-methoxyethyl N,N-bis(2-formamidoethyl)carbamate (CID 89335039) is 2-methoxyethyl N,N-bis(2-formamidoethyl)carbamate.
What is the SMILES notation for 2-methoxyethyl N,N-bis(2-formamidoethyl)carbamate?
The canonical SMILES for 2-methoxyethyl N,N-bis(2-formamidoethyl)carbamate is COCCOC(=O)N(CCNC=O)CCNC=O.
What is the InChIKey of 2-methoxyethyl N,N-bis(2-formamidoethyl)carbamate?
The InChIKey is YHOPKYYZERUFOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O5/c1-17-6-7-18-10(16)13(4-2-11-8-14)5-3-12-9-15/h8-9H,2-7H2,1H3,(H,11,14)(H,12,15).
What are the key properties of 2-methoxyethyl N,N-bis(2-formamidoethyl)carbamate?
2-methoxyethyl N,N-bis(2-formamidoethyl)carbamate has a molecular weight of 261.28 g/mol, XLogP of -1.44, 11 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyethyl N,N-bis(2-formamidoethyl)carbamate is sourced from PubChem (CID 89335039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).