(1Z)-1-[2-(cyclohexylamino)cyclohexylidene]ethanol

C14H25NO — CID 141282384

IUPAC(1Z)-1-[2-(cyclohexylamino)cyclohexylidene]ethanol
SMILESC/C(O)=C1\CCCCC1NC1CCCCC1
InChIInChI=1S/C14H25NO/c1-11(16)13-9-5-6-10-14(13)15-12-7-3-2-4-8-12/h12,14-16H,2-10H2,1H3/b13-11-
InChIKeyPGHXGYVGYSIMFG-QBFSEMIESA-N
MW223.36 g/mol
LogP3.68
Rot. Bonds2

About (1Z)-1-[2-(cyclohexylamino)cyclohexylidene]ethanol

(1Z)-1-[2-(cyclohexylamino)cyclohexylidene]ethanol (PubChem CID 141282384) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is (1Z)-1-[2-(cyclohexylamino)cyclohexylidene]ethanol.

Molecular Properties

Compound Name(1Z)-1-[2-(cyclohexylamino)cyclohexylidene]ethanol
PubChem CID141282384
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name(1Z)-1-[2-(cyclohexylamino)cyclohexylidene]ethanol
SMILESC/C(O)=C1\CCCCC1NC1CCCCC1
InChIInChI=1S/C14H25NO/c1-11(16)13-9-5-6-10-14(13)15-12-7-3-2-4-8-12/h12,14-16H,2-10H2,1H3/b13-11-
InChIKeyPGHXGYVGYSIMFG-QBFSEMIESA-N
XLogP3.68
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

N-cyclohexyl-2-propan-2-ylidenecyclohexan-1-amine
CID 66929974
(2Z,4Z,6E)-3-[(cyclohexylamino)methyl]undeca-2,4,6-trien-2-ol
CID 142528972
(Z)-4-[[(2-aminocyclohexyl)amino]methyl]hex-3-en-3-ol
CID 143004097

Frequently Asked Questions

What is the IUPAC name of (1Z)-1-[2-(cyclohexylamino)cyclohexylidene]ethanol?
The IUPAC name of (1Z)-1-[2-(cyclohexylamino)cyclohexylidene]ethanol (CID 141282384) is (1Z)-1-[2-(cyclohexylamino)cyclohexylidene]ethanol.
What is the SMILES notation for (1Z)-1-[2-(cyclohexylamino)cyclohexylidene]ethanol?
The canonical SMILES for (1Z)-1-[2-(cyclohexylamino)cyclohexylidene]ethanol is C/C(O)=C1\CCCCC1NC1CCCCC1.
What is the InChIKey of (1Z)-1-[2-(cyclohexylamino)cyclohexylidene]ethanol?
The InChIKey is PGHXGYVGYSIMFG-QBFSEMIESA-N. The full InChI is InChI=1S/C14H25NO/c1-11(16)13-9-5-6-10-14(13)15-12-7-3-2-4-8-12/h12,14-16H,2-10H2,1H3/b13-11-.
What are the key properties of (1Z)-1-[2-(cyclohexylamino)cyclohexylidene]ethanol?
(1Z)-1-[2-(cyclohexylamino)cyclohexylidene]ethanol has a molecular weight of 223.36 g/mol, XLogP of 3.68, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z)-1-[2-(cyclohexylamino)cyclohexylidene]ethanol is sourced from PubChem (CID 141282384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).