1-(benzenecarboximidoyl)cyclopentan-1-ol

C12H15NO — CID 15724674

IUPAC1-(benzenecarboximidoyl)cyclopentan-1-ol
SMILES[H]/N=C(\c1ccccc1)C1(O)CCCC1
InChIInChI=1S/C12H15NO/c13-11(10-6-2-1-3-7-10)12(14)8-4-5-9-12/h1-3,6-7,13-14H,4-5,8-9H2/b13-11+
InChIKeyDCNZSWHPTPAEOR-ACCUITESSA-N
MW189.26 g/mol
LogP2.36
Rot. Bonds2

About 1-(benzenecarboximidoyl)cyclopentan-1-ol

1-(benzenecarboximidoyl)cyclopentan-1-ol (PubChem CID 15724674) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is 1-(benzenecarboximidoyl)cyclopentan-1-ol.

Molecular Properties

Compound Name1-(benzenecarboximidoyl)cyclopentan-1-ol
PubChem CID15724674
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC Name1-(benzenecarboximidoyl)cyclopentan-1-ol
SMILES[H]/N=C(\c1ccccc1)C1(O)CCCC1
InChIInChI=1S/C12H15NO/c13-11(10-6-2-1-3-7-10)12(14)8-4-5-9-12/h1-3,6-7,13-14H,4-5,8-9H2/b13-11+
InChIKeyDCNZSWHPTPAEOR-ACCUITESSA-N
XLogP2.36
TPSA44.08 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(benzenecarboximidoyl)cyclopentan-1-ol?
The IUPAC name of 1-(benzenecarboximidoyl)cyclopentan-1-ol (CID 15724674) is 1-(benzenecarboximidoyl)cyclopentan-1-ol.
What is the SMILES notation for 1-(benzenecarboximidoyl)cyclopentan-1-ol?
The canonical SMILES for 1-(benzenecarboximidoyl)cyclopentan-1-ol is [H]/N=C(\c1ccccc1)C1(O)CCCC1.
What is the InChIKey of 1-(benzenecarboximidoyl)cyclopentan-1-ol?
The InChIKey is DCNZSWHPTPAEOR-ACCUITESSA-N. The full InChI is InChI=1S/C12H15NO/c13-11(10-6-2-1-3-7-10)12(14)8-4-5-9-12/h1-3,6-7,13-14H,4-5,8-9H2/b13-11+.
What are the key properties of 1-(benzenecarboximidoyl)cyclopentan-1-ol?
1-(benzenecarboximidoyl)cyclopentan-1-ol has a molecular weight of 189.26 g/mol, XLogP of 2.36, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(benzenecarboximidoyl)cyclopentan-1-ol is sourced from PubChem (CID 15724674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).