(4-methanimidoylcyclohexyl)methanol

C8H15NO — CID 57190486

IUPAC(4-methanimidoylcyclohexyl)methanol
SMILES[H]/N=C/C1CCC(CO)CC1
InChIInChI=1S/C8H15NO/c9-5-7-1-3-8(6-10)4-2-7/h5,7-10H,1-4,6H2/b9-5+
InChIKeySGVDSAHMTJNQLP-WEVVVXLNSA-N
MW141.21 g/mol
LogP1.43
Rot. Bonds2

About (4-methanimidoylcyclohexyl)methanol

(4-methanimidoylcyclohexyl)methanol (PubChem CID 57190486) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is (4-methanimidoylcyclohexyl)methanol.

Molecular Properties

Compound Name(4-methanimidoylcyclohexyl)methanol
PubChem CID57190486
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name(4-methanimidoylcyclohexyl)methanol
SMILES[H]/N=C/C1CCC(CO)CC1
InChIInChI=1S/C8H15NO/c9-5-7-1-3-8(6-10)4-2-7/h5,7-10H,1-4,6H2/b9-5+
InChIKeySGVDSAHMTJNQLP-WEVVVXLNSA-N
XLogP1.43
TPSA44.08 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.43
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 (4-methanimidoylcyclohexyl)methanol?
The IUPAC name of (4-methanimidoylcyclohexyl)methanol (CID 57190486) is (4-methanimidoylcyclohexyl)methanol.
What is the SMILES notation for (4-methanimidoylcyclohexyl)methanol?
The canonical SMILES for (4-methanimidoylcyclohexyl)methanol is [H]/N=C/C1CCC(CO)CC1.
What is the InChIKey of (4-methanimidoylcyclohexyl)methanol?
The InChIKey is SGVDSAHMTJNQLP-WEVVVXLNSA-N. The full InChI is InChI=1S/C8H15NO/c9-5-7-1-3-8(6-10)4-2-7/h5,7-10H,1-4,6H2/b9-5+.
What are the key properties of (4-methanimidoylcyclohexyl)methanol?
(4-methanimidoylcyclohexyl)methanol has a molecular weight of 141.21 g/mol, XLogP of 1.43, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methanimidoylcyclohexyl)methanol is sourced from PubChem (CID 57190486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).