2-oxodecyl carbamate

C11H21NO3 — CID 175306770

IUPAC2-oxodecyl carbamate
SMILESCCCCCCCCC(=O)COC(N)=O
InChIInChI=1S/C11H21NO3/c1-2-3-4-5-6-7-8-10(13)9-15-11(12)14/h2-9H2,1H3,(H2,12,14)
InChIKeyGECVEBLREYWEIB-UHFFFAOYSA-N
MW215.29 g/mol
LogP2.40
Rot. Bonds9

About 2-oxodecyl carbamate

2-oxodecyl carbamate (PubChem CID 175306770) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is 2-oxodecyl carbamate.

Molecular Properties

Compound Name2-oxodecyl carbamate
PubChem CID175306770
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC Name2-oxodecyl carbamate
SMILESCCCCCCCCC(=O)COC(N)=O
InChIInChI=1S/C11H21NO3/c1-2-3-4-5-6-7-8-10(13)9-15-11(12)14/h2-9H2,1H3,(H2,12,14)
InChIKeyGECVEBLREYWEIB-UHFFFAOYSA-N
XLogP2.40
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-methoxydecan-2-one
CID 10352423
(3-heptanoyloxy-2-oxopropyl) heptanoate
CID 134318597
1-ethoxyhexadecan-2-one
CID 58991968
pentacosan-7-one
CID 54551687
nonadecan-7-one
CID 12913434
pentacosane-7,19-dione
CID 139254510
nonatriacontane-8,29-dione
CID 150237018
pentadecan-8-one
CID 13162
tricosan-12-one
CID 10888
octacosan-8-one
CID 86052342
1-hexoxyundecan-2-one
CID 57063853
1-(2-aminoethoxy)dodecan-2-one
CID 116590896

Frequently Asked Questions

What is the IUPAC name of 2-oxodecyl carbamate?
The IUPAC name of 2-oxodecyl carbamate (CID 175306770) is 2-oxodecyl carbamate.
What is the SMILES notation for 2-oxodecyl carbamate?
The canonical SMILES for 2-oxodecyl carbamate is CCCCCCCCC(=O)COC(N)=O.
What is the InChIKey of 2-oxodecyl carbamate?
The InChIKey is GECVEBLREYWEIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c1-2-3-4-5-6-7-8-10(13)9-15-11(12)14/h2-9H2,1H3,(H2,12,14).
What are the key properties of 2-oxodecyl carbamate?
2-oxodecyl carbamate has a molecular weight of 215.29 g/mol, XLogP of 2.40, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxodecyl carbamate is sourced from PubChem (CID 175306770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).