(1R,4E,8S)-4-hydrazinylidenetricyclo[4.3.1.13,8]undecan-3-ol

C11H18N2O — CID 11074295

IUPAC(1R,4E,8S)-4-hydrazinylidenetricyclo[4.3.1.13,8]undecan-3-ol
SMILESN/N=C1\CC2C[C@@H]3C[C@H](C2)CC1(O)C3
InChIInChI=1S/C11H18N2O/c12-13-10-4-7-1-8-3-9(2-7)6-11(10,14)5-8/h7-9,14H,1-6,12H2/b13-10+/t7?,8-,9+,11?
InChIKeyNOIYYRJJCOYGOZ-SEYXPINJSA-N
MW194.28 g/mol
LogP1.26
Rot. Bonds

About (1R,4E,8S)-4-hydrazinylidenetricyclo[4.3.1.13,8]undecan-3-ol

(1R,4E,8S)-4-hydrazinylidenetricyclo[4.3.1.13,8]undecan-3-ol (PubChem CID 11074295) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is (1R,4E,8S)-4-hydrazinylidenetricyclo[4.3.1.13,8]undecan-3-ol.

Molecular Properties

Compound Name(1R,4E,8S)-4-hydrazinylidenetricyclo[4.3.1.13,8]undecan-3-ol
PubChem CID11074295
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name(1R,4E,8S)-4-hydrazinylidenetricyclo[4.3.1.13,8]undecan-3-ol
SMILESN/N=C1\CC2C[C@@H]3C[C@H](C2)CC1(O)C3
InChIInChI=1S/C11H18N2O/c12-13-10-4-7-1-8-3-9(2-7)6-11(10,14)5-8/h7-9,14H,1-6,12H2/b13-10+/t7?,8-,9+,11?
InChIKeyNOIYYRJJCOYGOZ-SEYXPINJSA-N
XLogP1.26
TPSA58.61 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'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 (1R,4E,8S)-4-hydrazinylidenetricyclo[4.3.1.13,8]undecan-3-ol?
The IUPAC name of (1R,4E,8S)-4-hydrazinylidenetricyclo[4.3.1.13,8]undecan-3-ol (CID 11074295) is (1R,4E,8S)-4-hydrazinylidenetricyclo[4.3.1.13,8]undecan-3-ol.
What is the SMILES notation for (1R,4E,8S)-4-hydrazinylidenetricyclo[4.3.1.13,8]undecan-3-ol?
The canonical SMILES for (1R,4E,8S)-4-hydrazinylidenetricyclo[4.3.1.13,8]undecan-3-ol is N/N=C1\CC2C[C@@H]3C[C@H](C2)CC1(O)C3.
What is the InChIKey of (1R,4E,8S)-4-hydrazinylidenetricyclo[4.3.1.13,8]undecan-3-ol?
The InChIKey is NOIYYRJJCOYGOZ-SEYXPINJSA-N. The full InChI is InChI=1S/C11H18N2O/c12-13-10-4-7-1-8-3-9(2-7)6-11(10,14)5-8/h7-9,14H,1-6,12H2/b13-10+/t7?,8-,9+,11?.
What are the key properties of (1R,4E,8S)-4-hydrazinylidenetricyclo[4.3.1.13,8]undecan-3-ol?
(1R,4E,8S)-4-hydrazinylidenetricyclo[4.3.1.13,8]undecan-3-ol has a molecular weight of 194.28 g/mol, XLogP of 1.26, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,4E,8S)-4-hydrazinylidenetricyclo[4.3.1.13,8]undecan-3-ol is sourced from PubChem (CID 11074295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).