(2-hydroxycyclohexyl)-methylidyneazanium

C7H12NO+ — CID 6328953

IUPAC(2-hydroxycyclohexyl)-methylidyneazanium
SMILESC#[N+]C1CCCCC1O
InChIInChI=1S/C7H12NO/c1-8-6-4-2-3-5-7(6)9/h1,6-7,9H,2-5H2/q+1
InChIKeyZJANGZOKUHKAQR-UHFFFAOYSA-N
MW126.18 g/mol
LogP1.25
Rot. Bonds

About (2-hydroxycyclohexyl)-methylidyneazanium

(2-hydroxycyclohexyl)-methylidyneazanium (PubChem CID 6328953) has the molecular formula C7H12NO+ and a molecular weight of 126.18 g/mol. Its IUPAC name is (2-hydroxycyclohexyl)-methylidyneazanium.

Molecular Properties

Compound Name(2-hydroxycyclohexyl)-methylidyneazanium
PubChem CID6328953
Molecular FormulaC7H12NO+
Molecular Weight126.18 g/mol
Exact Mass126.09
IUPAC Name(2-hydroxycyclohexyl)-methylidyneazanium
SMILESC#[N+]C1CCCCC1O
InChIInChI=1S/C7H12NO/c1-8-6-4-2-3-5-7(6)9/h1,6-7,9H,2-5H2/q+1
InChIKeyZJANGZOKUHKAQR-UHFFFAOYSA-N
XLogP1.25
TPSA24.59 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.18
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

trans-(1S,2S)-cyclohexane-1,2-diol;trans-(1R,2R)-cyclohexane-1,2-diol
CID 121492980
trans-(1S,2S)-cyclooctane-1,2-diol
CID 7273013
cycloundecane-1,2-diol
CID 67185134
cis-(1S,2R)-2-ethynylcyclohexan-1-ol
CID 11469076
cis-(1S,2R)-2-aminocyclohexan-1-ol
CID 2724651
cyclohexane-1,2-diol;ethane;propane
CID 143149782
trans-(1R,2R)-2-bromocyclohexan-1-ol
CID 10866921
trans-(1R,2R)-2-pyrrolidin-1-ylcyclohexan-1-ol
CID 10103566
cis-(1S,2R)-2-pyrrolidin-1-ylcyclohexan-1-ol
CID 23656399
2-[(E)-but-1-en-3-ynyl]cyclohexan-1-ol
CID 18414980
cis-(1R,2S)-2-azidocyclohexan-1-ol;molecular fluorine
CID 167634886
ethane;(1R)-2-methylcyclohexan-1-ol
CID 142359109

Frequently Asked Questions

What is the IUPAC name of (2-hydroxycyclohexyl)-methylidyneazanium?
The IUPAC name of (2-hydroxycyclohexyl)-methylidyneazanium (CID 6328953) is (2-hydroxycyclohexyl)-methylidyneazanium.
What is the SMILES notation for (2-hydroxycyclohexyl)-methylidyneazanium?
The canonical SMILES for (2-hydroxycyclohexyl)-methylidyneazanium is C#[N+]C1CCCCC1O.
What is the InChIKey of (2-hydroxycyclohexyl)-methylidyneazanium?
The InChIKey is ZJANGZOKUHKAQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12NO/c1-8-6-4-2-3-5-7(6)9/h1,6-7,9H,2-5H2/q+1.
What are the key properties of (2-hydroxycyclohexyl)-methylidyneazanium?
(2-hydroxycyclohexyl)-methylidyneazanium has a molecular weight of 126.18 g/mol, XLogP of 1.25, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydroxycyclohexyl)-methylidyneazanium is sourced from PubChem (CID 6328953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).