[(Z)-(3-methylcyclooctylidene)amino]urea

C10H19N3O — CID 90482071

IUPAC[(Z)-(3-methylcyclooctylidene)amino]urea
SMILESCC1CCCCC/C(=N/NC(N)=O)C1
InChIInChI=1S/C10H19N3O/c1-8-5-3-2-4-6-9(7-8)12-13-10(11)14/h8H,2-7H2,1H3,(H3,11,13,14)/b12-9-
InChIKeyMUGUGZLJJDDGGH-XFXZXTDPSA-N
MW197.28 g/mol
LogP2.00
Rot. Bonds1

About [(Z)-(3-methylcyclooctylidene)amino]urea

[(Z)-(3-methylcyclooctylidene)amino]urea (PubChem CID 90482071) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is [(Z)-(3-methylcyclooctylidene)amino]urea.

Molecular Properties

Compound Name[(Z)-(3-methylcyclooctylidene)amino]urea
PubChem CID90482071
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name[(Z)-(3-methylcyclooctylidene)amino]urea
SMILESCC1CCCCC/C(=N/NC(N)=O)C1
InChIInChI=1S/C10H19N3O/c1-8-5-3-2-4-6-9(7-8)12-13-10(11)14/h8H,2-7H2,1H3,(H3,11,13,14)/b12-9-
InChIKeyMUGUGZLJJDDGGH-XFXZXTDPSA-N
XLogP2.00
TPSA67.48 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(Z)-(3-methylcyclooctylidene)amino]urea?
The IUPAC name of [(Z)-(3-methylcyclooctylidene)amino]urea (CID 90482071) is [(Z)-(3-methylcyclooctylidene)amino]urea.
What is the SMILES notation for [(Z)-(3-methylcyclooctylidene)amino]urea?
The canonical SMILES for [(Z)-(3-methylcyclooctylidene)amino]urea is CC1CCCCC/C(=N/NC(N)=O)C1.
What is the InChIKey of [(Z)-(3-methylcyclooctylidene)amino]urea?
The InChIKey is MUGUGZLJJDDGGH-XFXZXTDPSA-N. The full InChI is InChI=1S/C10H19N3O/c1-8-5-3-2-4-6-9(7-8)12-13-10(11)14/h8H,2-7H2,1H3,(H3,11,13,14)/b12-9-.
What are the key properties of [(Z)-(3-methylcyclooctylidene)amino]urea?
[(Z)-(3-methylcyclooctylidene)amino]urea has a molecular weight of 197.28 g/mol, XLogP of 2.00, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-(3-methylcyclooctylidene)amino]urea is sourced from PubChem (CID 90482071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).