[(Z)-2-ethoxyethylideneamino]carbamic acid

C5H10N2O3 — CID 90015169

IUPAC[(Z)-2-ethoxyethylideneamino]carbamic acid
SMILESCCOC/C=N\NC(=O)O
InChIInChI=1S/C5H10N2O3/c1-2-10-4-3-6-7-5(8)9/h3,7H,2,4H2,1H3,(H,8,9)/b6-3-
InChIKeyRUDTZHFVFFXXQE-UTCJRWHESA-N
MW146.15 g/mol
LogP0.28
Rot. Bonds4

About [(Z)-2-ethoxyethylideneamino]carbamic acid

[(Z)-2-ethoxyethylideneamino]carbamic acid (PubChem CID 90015169) has the molecular formula C5H10N2O3 and a molecular weight of 146.15 g/mol. Its IUPAC name is [(Z)-2-ethoxyethylideneamino]carbamic acid.

Molecular Properties

Compound Name[(Z)-2-ethoxyethylideneamino]carbamic acid
PubChem CID90015169
Molecular FormulaC5H10N2O3
Molecular Weight146.15 g/mol
Exact Mass146.07
IUPAC Name[(Z)-2-ethoxyethylideneamino]carbamic acid
SMILESCCOC/C=N\NC(=O)O
InChIInChI=1S/C5H10N2O3/c1-2-10-4-3-6-7-5(8)9/h3,7H,2,4H2,1H3,(H,8,9)/b6-3-
InChIKeyRUDTZHFVFFXXQE-UTCJRWHESA-N
XLogP0.28
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.15
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

ethyl N-(2-chloroethylideneamino)carbamate
CID 3017310
2-ethoxy-N-ethylethanimine
CID 22960347
N-[(Z)-butylideneamino]acetamide
CID 6015140
4,6-diethoxyhex-4-en-2-one
CID 151227780
ethyl N-(3-methylsulfanylpropylideneamino)carbamate
CID 131853339
diethyl 2-(2-ethoxyethylidene)propanedioate
CID 54239244
ethoxyethane;methyl carbamate
CID 18755981
ethyl N-(dimethylaminomethylideneamino)carbamate
CID 54558834
N,N'-bis(butylideneamino)heptanediamide
CID 4260370
ethyl (1E)-N-ethoxycarbonylmethanehydrazonate
CID 118933419
methyl 4-ethoxy-2-ethylbut-2-enoate
CID 77100412
N-(butylideneamino)-2-phenoxypropanamide
CID 4633642

Frequently Asked Questions

What is the IUPAC name of [(Z)-2-ethoxyethylideneamino]carbamic acid?
The IUPAC name of [(Z)-2-ethoxyethylideneamino]carbamic acid (CID 90015169) is [(Z)-2-ethoxyethylideneamino]carbamic acid.
What is the SMILES notation for [(Z)-2-ethoxyethylideneamino]carbamic acid?
The canonical SMILES for [(Z)-2-ethoxyethylideneamino]carbamic acid is CCOC/C=N\NC(=O)O.
What is the InChIKey of [(Z)-2-ethoxyethylideneamino]carbamic acid?
The InChIKey is RUDTZHFVFFXXQE-UTCJRWHESA-N. The full InChI is InChI=1S/C5H10N2O3/c1-2-10-4-3-6-7-5(8)9/h3,7H,2,4H2,1H3,(H,8,9)/b6-3-.
What are the key properties of [(Z)-2-ethoxyethylideneamino]carbamic acid?
[(Z)-2-ethoxyethylideneamino]carbamic acid has a molecular weight of 146.15 g/mol, XLogP of 0.28, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-2-ethoxyethylideneamino]carbamic acid is sourced from PubChem (CID 90015169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).