(8-azaniumylidene-9-hydroxy-1-methoxynonylidene)azanide

C10H20N2O2 — CID 58363670

IUPAC(8-azaniumylidene-9-hydroxy-1-methoxynonylidene)azanide
SMILESCOC(=[N-])CCCCCCC(=[NH2+])CO
InChIInChI=1S/C10H19N2O2/c1-14-10(12)7-5-3-2-4-6-9(11)8-13/h11,13H,2-8H2,1H3/q-1/p+1
InChIKeyJVYCBQBDADHFIK-UHFFFAOYSA-O
MW200.28 g/mol
LogP0.13
Rot. Bonds8

About (8-azaniumylidene-9-hydroxy-1-methoxynonylidene)azanide

(8-azaniumylidene-9-hydroxy-1-methoxynonylidene)azanide (PubChem CID 58363670) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is (8-azaniumylidene-9-hydroxy-1-methoxynonylidene)azanide.

Molecular Properties

Compound Name(8-azaniumylidene-9-hydroxy-1-methoxynonylidene)azanide
PubChem CID58363670
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name(8-azaniumylidene-9-hydroxy-1-methoxynonylidene)azanide
SMILESCOC(=[N-])CCCCCCC(=[NH2+])CO
InChIInChI=1S/C10H19N2O2/c1-14-10(12)7-5-3-2-4-6-9(11)8-13/h11,13H,2-8H2,1H3/q-1/p+1
InChIKeyJVYCBQBDADHFIK-UHFFFAOYSA-O
XLogP0.13
TPSA77.35 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

4-(Hydroxyhydrazinylidene)octan-1-ol
CID 53698584
Ethylenebis(2-iminobutanol)
CID 129868085
6-Iminooctan-1-ol
CID 54459280
3-Iminoicosan-1-ol
CID 57124118
3-Iminooctan-1-ol
CID 57224710
3-Iminododecan-1-ol
CID 57239624
(9-Azaniumylidene-1-hydroxy-9-methoxynonan-2-ylidene)azanium
CID 58301386
Methyl 9-hydroxy-8-iminononanimidate
CID 58301387
[8-(Amino-lambda3-chloranylidene)-9-hydroxy-1-methoxynonylidene]azanium
CID 58332318
[7-(Amino-lambda3-chloranylidene)-8-hydroxy-1-methoxyoctylidene]azanium
CID 58332322
1-Methoxyoctan-2-imine
CID 87831006
Methyl 6-hydroxy-5-iminohexanimidate
CID 88554259

Frequently Asked Questions

What is the IUPAC name of (8-azaniumylidene-9-hydroxy-1-methoxynonylidene)azanide?
The IUPAC name of (8-azaniumylidene-9-hydroxy-1-methoxynonylidene)azanide (CID 58363670) is (8-azaniumylidene-9-hydroxy-1-methoxynonylidene)azanide.
What is the SMILES notation for (8-azaniumylidene-9-hydroxy-1-methoxynonylidene)azanide?
The canonical SMILES for (8-azaniumylidene-9-hydroxy-1-methoxynonylidene)azanide is COC(=[N-])CCCCCCC(=[NH2+])CO.
What is the InChIKey of (8-azaniumylidene-9-hydroxy-1-methoxynonylidene)azanide?
The InChIKey is JVYCBQBDADHFIK-UHFFFAOYSA-O. The full InChI is InChI=1S/C10H19N2O2/c1-14-10(12)7-5-3-2-4-6-9(11)8-13/h11,13H,2-8H2,1H3/q-1/p+1.
What are the key properties of (8-azaniumylidene-9-hydroxy-1-methoxynonylidene)azanide?
(8-azaniumylidene-9-hydroxy-1-methoxynonylidene)azanide has a molecular weight of 200.28 g/mol, XLogP of 0.13, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (8-azaniumylidene-9-hydroxy-1-methoxynonylidene)azanide is sourced from PubChem (CID 58363670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).