(1-methoxycyclohexyl)-propan-2-yldiazene

C10H20N2O — CID 21387145

IUPAC(1-methoxycyclohexyl)-propan-2-yldiazene
SMILESCOC1(/N=N/C(C)C)CCCCC1
InChIInChI=1S/C10H20N2O/c1-9(2)11-12-10(13-3)7-5-4-6-8-10/h9H,4-8H2,1-3H3/b12-11+
InChIKeyKVIXHKFVUUZRTP-VAWYXSNFSA-N
MW184.28 g/mol
LogP3.15
Rot. Bonds3

About (1-methoxycyclohexyl)-propan-2-yldiazene

(1-methoxycyclohexyl)-propan-2-yldiazene (PubChem CID 21387145) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is (1-methoxycyclohexyl)-propan-2-yldiazene.

Molecular Properties

Compound Name(1-methoxycyclohexyl)-propan-2-yldiazene
PubChem CID21387145
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name(1-methoxycyclohexyl)-propan-2-yldiazene
SMILESCOC1(/N=N/C(C)C)CCCCC1
InChIInChI=1S/C10H20N2O/c1-9(2)11-12-10(13-3)7-5-4-6-8-10/h9H,4-8H2,1-3H3/b12-11+
InChIKeyKVIXHKFVUUZRTP-VAWYXSNFSA-N
XLogP3.15
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (1-methoxycyclohexyl)-propan-2-yldiazene?
The IUPAC name of (1-methoxycyclohexyl)-propan-2-yldiazene (CID 21387145) is (1-methoxycyclohexyl)-propan-2-yldiazene.
What is the SMILES notation for (1-methoxycyclohexyl)-propan-2-yldiazene?
The canonical SMILES for (1-methoxycyclohexyl)-propan-2-yldiazene is COC1(/N=N/C(C)C)CCCCC1.
What is the InChIKey of (1-methoxycyclohexyl)-propan-2-yldiazene?
The InChIKey is KVIXHKFVUUZRTP-VAWYXSNFSA-N. The full InChI is InChI=1S/C10H20N2O/c1-9(2)11-12-10(13-3)7-5-4-6-8-10/h9H,4-8H2,1-3H3/b12-11+.
What are the key properties of (1-methoxycyclohexyl)-propan-2-yldiazene?
(1-methoxycyclohexyl)-propan-2-yldiazene has a molecular weight of 184.28 g/mol, XLogP of 3.15, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxycyclohexyl)-propan-2-yldiazene is sourced from PubChem (CID 21387145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).