(NZ)-N-(3-propylhexan-2-ylidene)hydroxylamine

C9H19NO — CID 6509884

IUPAC(NZ)-N-(3-propylhexan-2-ylidene)hydroxylamine
SMILESCCCC(CCC)/C(C)=N\O
InChIInChI=1S/C9H19NO/c1-4-6-9(7-5-2)8(3)10-11/h9,11H,4-7H2,1-3H3/b10-8-
InChIKeyJKUFWRDSSYNRPE-NTMALXAHSA-N
MW157.26 g/mol
LogP3.05
Rot. Bonds5

About (NZ)-N-(3-propylhexan-2-ylidene)hydroxylamine

(NZ)-N-(3-propylhexan-2-ylidene)hydroxylamine (PubChem CID 6509884) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is (NZ)-N-(3-propylhexan-2-ylidene)hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-(3-propylhexan-2-ylidene)hydroxylamine
PubChem CID6509884
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name(NZ)-N-(3-propylhexan-2-ylidene)hydroxylamine
SMILESCCCC(CCC)/C(C)=N\O
InChIInChI=1S/C9H19NO/c1-4-6-9(7-5-2)8(3)10-11/h9,11H,4-7H2,1-3H3/b10-8-
InChIKeyJKUFWRDSSYNRPE-NTMALXAHSA-N
XLogP3.05
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_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 (NZ)-N-(3-propylhexan-2-ylidene)hydroxylamine?
The IUPAC name of (NZ)-N-(3-propylhexan-2-ylidene)hydroxylamine (CID 6509884) is (NZ)-N-(3-propylhexan-2-ylidene)hydroxylamine.
What is the SMILES notation for (NZ)-N-(3-propylhexan-2-ylidene)hydroxylamine?
The canonical SMILES for (NZ)-N-(3-propylhexan-2-ylidene)hydroxylamine is CCCC(CCC)/C(C)=N\O.
What is the InChIKey of (NZ)-N-(3-propylhexan-2-ylidene)hydroxylamine?
The InChIKey is JKUFWRDSSYNRPE-NTMALXAHSA-N. The full InChI is InChI=1S/C9H19NO/c1-4-6-9(7-5-2)8(3)10-11/h9,11H,4-7H2,1-3H3/b10-8-.
What are the key properties of (NZ)-N-(3-propylhexan-2-ylidene)hydroxylamine?
(NZ)-N-(3-propylhexan-2-ylidene)hydroxylamine has a molecular weight of 157.26 g/mol, XLogP of 3.05, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-(3-propylhexan-2-ylidene)hydroxylamine is sourced from PubChem (CID 6509884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).