methyl N-[1-cyclopent-2-en-1-yl-2-(methoxyamino)-2-oxoethyl]carbamate

C10H16N2O4 — CID 10105166

IUPACmethyl N-[1-cyclopent-2-en-1-yl-2-(methoxyamino)-2-oxoethyl]carbamate
SMILESCONC(=O)C(NC(=O)OC)C1C=CCC1
InChIInChI=1S/C10H16N2O4/c1-15-10(14)11-8(9(13)12-16-2)7-5-3-4-6-7/h3,5,7-8H,4,6H2,1-2H3,(H,11,14)(H,12,13)
InChIKeyUMUPSUDMOYGJKI-UHFFFAOYSA-N
MW228.25 g/mol
LogP0.35
Rot. Bonds4

About methyl N-[1-cyclopent-2-en-1-yl-2-(methoxyamino)-2-oxoethyl]carbamate

methyl N-[1-cyclopent-2-en-1-yl-2-(methoxyamino)-2-oxoethyl]carbamate (PubChem CID 10105166) has the molecular formula C10H16N2O4 and a molecular weight of 228.25 g/mol. Its IUPAC name is methyl N-[1-cyclopent-2-en-1-yl-2-(methoxyamino)-2-oxoethyl]carbamate.

Molecular Properties

Compound Namemethyl N-[1-cyclopent-2-en-1-yl-2-(methoxyamino)-2-oxoethyl]carbamate
PubChem CID10105166
Molecular FormulaC10H16N2O4
Molecular Weight228.25 g/mol
Exact Mass228.11
IUPAC Namemethyl N-[1-cyclopent-2-en-1-yl-2-(methoxyamino)-2-oxoethyl]carbamate
SMILESCONC(=O)C(NC(=O)OC)C1C=CCC1
InChIInChI=1S/C10H16N2O4/c1-15-10(14)11-8(9(13)12-16-2)7-5-3-4-6-7/h3,5,7-8H,4,6H2,1-2H3,(H,11,14)(H,12,13)
InChIKeyUMUPSUDMOYGJKI-UHFFFAOYSA-N
XLogP0.35
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

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CID 55301012
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CID 11137554
3-(dimethoxymethyl)cyclopentene
CID 12723451
ethane;methyl N-(1-cyclopropyl-2-oxopropyl)carbamate
CID 143630049
(2S)-2-cyclopent-2-en-1-yl-2-hydroxyacetic acid
CID 70607167
methyl N-(2-oxo-3a,4,5,7a-tetrahydro-3H-1-benzofuran-3-yl)carbamate
CID 15569863
[(1S)-cyclopent-2-en-1-yl]methanediol
CID 134407008
methyl N-[2-amino-1-(oxan-4-yl)-2-oxoethyl]carbamate
CID 123481327
methyl N-[1-(methoxyamino)-4-methyl-1-oxopentan-2-yl]carbamate
CID 47407232
methyl N-(1-cyclopropyl-2-methylbut-2-enyl)carbamate
CID 118066650
dimethyl 2-cyclohex-2-en-1-ylbutanedioate
CID 121012501
(2S)-2-cyclopent-2-en-1-yl-2-methylsulfonyloxyacetic acid
CID 88796081

Frequently Asked Questions

What is the IUPAC name of methyl N-[1-cyclopent-2-en-1-yl-2-(methoxyamino)-2-oxoethyl]carbamate?
The IUPAC name of methyl N-[1-cyclopent-2-en-1-yl-2-(methoxyamino)-2-oxoethyl]carbamate (CID 10105166) is methyl N-[1-cyclopent-2-en-1-yl-2-(methoxyamino)-2-oxoethyl]carbamate.
What is the SMILES notation for methyl N-[1-cyclopent-2-en-1-yl-2-(methoxyamino)-2-oxoethyl]carbamate?
The canonical SMILES for methyl N-[1-cyclopent-2-en-1-yl-2-(methoxyamino)-2-oxoethyl]carbamate is CONC(=O)C(NC(=O)OC)C1C=CCC1.
What is the InChIKey of methyl N-[1-cyclopent-2-en-1-yl-2-(methoxyamino)-2-oxoethyl]carbamate?
The InChIKey is UMUPSUDMOYGJKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O4/c1-15-10(14)11-8(9(13)12-16-2)7-5-3-4-6-7/h3,5,7-8H,4,6H2,1-2H3,(H,11,14)(H,12,13).
What are the key properties of methyl N-[1-cyclopent-2-en-1-yl-2-(methoxyamino)-2-oxoethyl]carbamate?
methyl N-[1-cyclopent-2-en-1-yl-2-(methoxyamino)-2-oxoethyl]carbamate has a molecular weight of 228.25 g/mol, XLogP of 0.35, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[1-cyclopent-2-en-1-yl-2-(methoxyamino)-2-oxoethyl]carbamate is sourced from PubChem (CID 10105166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).