[[(E)-dec-2-enylidene]amino]urea

C11H21N3O — CID 165430179

IUPAC[[(E)-dec-2-enylidene]amino]urea
SMILESCCCCCCC/C=C/C=NNC(N)=O
InChIInChI=1S/C11H21N3O/c1-2-3-4-5-6-7-8-9-10-13-14-11(12)15/h8-10H,2-7H2,1H3,(H3,12,14,15)/b9-8+,13-10?
InChIKeyORVFBYVGLHGIGF-SABKRDHFSA-N
MW211.31 g/mol
LogP2.56
Rot. Bonds8

About [[(E)-dec-2-enylidene]amino]urea

[[(E)-dec-2-enylidene]amino]urea (PubChem CID 165430179) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is [[(E)-dec-2-enylidene]amino]urea.

Molecular Properties

Compound Name[[(E)-dec-2-enylidene]amino]urea
PubChem CID165430179
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name[[(E)-dec-2-enylidene]amino]urea
SMILESCCCCCCC/C=C/C=NNC(N)=O
InChIInChI=1S/C11H21N3O/c1-2-3-4-5-6-7-8-9-10-13-14-11(12)15/h8-10H,2-7H2,1H3,(H3,12,14,15)/b9-8+,13-10?
InChIKeyORVFBYVGLHGIGF-SABKRDHFSA-N
XLogP2.56
TPSA67.48 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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

(nonadec-10-en-2-ylideneamino)urea
CID 71326598
nonadec-3-enamide
CID 54215031
icosa-2,4-dienamide
CID 123364114
(2E,4Z)-deca-2,4-dienamide
CID 87184515
(2E,4E)-2-methylpentadeca-2,4-dienamide
CID 169003282
(2E,4E)-2-methylheptacosa-2,4-dienamide
CID 169003266
2-methyltrideca-2,4-dienamide
CID 154353968
2-methyldodeca-2,4-dienamide
CID 168877598
2-methylpentadeca-2,4-dienamide
CID 168877600
(Z)-tricos-15-enamide
CID 155109212
octadec-9-enamide
CID 75990485
(Z)-non-2-enamide
CID 97047009

Frequently Asked Questions

What is the IUPAC name of [[(E)-dec-2-enylidene]amino]urea?
The IUPAC name of [[(E)-dec-2-enylidene]amino]urea (CID 165430179) is [[(E)-dec-2-enylidene]amino]urea.
What is the SMILES notation for [[(E)-dec-2-enylidene]amino]urea?
The canonical SMILES for [[(E)-dec-2-enylidene]amino]urea is CCCCCCC/C=C/C=NNC(N)=O.
What is the InChIKey of [[(E)-dec-2-enylidene]amino]urea?
The InChIKey is ORVFBYVGLHGIGF-SABKRDHFSA-N. The full InChI is InChI=1S/C11H21N3O/c1-2-3-4-5-6-7-8-9-10-13-14-11(12)15/h8-10H,2-7H2,1H3,(H3,12,14,15)/b9-8+,13-10?.
What are the key properties of [[(E)-dec-2-enylidene]amino]urea?
[[(E)-dec-2-enylidene]amino]urea has a molecular weight of 211.31 g/mol, XLogP of 2.56, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [[(E)-dec-2-enylidene]amino]urea is sourced from PubChem (CID 165430179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).