N-tridecan-2-ylidenehydroxylamine

C13H27NO — CID 74054313

IUPACN-tridecan-2-ylidenehydroxylamine
SMILESCCCCCCCCCCCC(C)=NO
InChIInChI=1S/C13H27NO/c1-3-4-5-6-7-8-9-10-11-12-13(2)14-15/h15H,3-12H2,1-2H3
InChIKeyRISFWNKJKLLNOV-UHFFFAOYSA-N
MW213.36 g/mol
LogP4.76
Rot. Bonds10

About N-tridecan-2-ylidenehydroxylamine

N-tridecan-2-ylidenehydroxylamine (PubChem CID 74054313) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is N-tridecan-2-ylidenehydroxylamine.

Molecular Properties

Compound NameN-tridecan-2-ylidenehydroxylamine
PubChem CID74054313
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC NameN-tridecan-2-ylidenehydroxylamine
SMILESCCCCCCCCCCCC(C)=NO
InChIInChI=1S/C13H27NO/c1-3-4-5-6-7-8-9-10-11-12-13(2)14-15/h15H,3-12H2,1-2H3
InChIKeyRISFWNKJKLLNOV-UHFFFAOYSA-N
XLogP4.76
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 54.76
H-Bond Donors ≤ 51
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': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-tetradecan-2-ylidenehydroxylamine
CID 140688122
(NZ)-N-[(2E)-2-hydroxyiminoundecan-3-ylidene]hydroxylamine
CID 137128745
N-[(Z)-decan-2-ylideneamino]-N-methylmethanamine
CID 6506660
(NZ)-N-[(2E)-2-hydroxyiminodecan-3-ylidene]hydroxylamine
CID 135992390
N-(1-hydroxyiminooctan-2-ylidene)hydroxylamine
CID 141296672
2-(nonan-2-ylideneamino)guanidine
CID 76873061
8,9-dimethylhexadec-8-ene
CID 140717938
[(E)-nonan-2-ylideneamino] acetate
CID 87079098
N,N'-bis(undecan-2-ylideneamino)oxamide
CID 3097994
2-methyl-N-[(E)-undecan-2-ylideneamino]propan-2-amine
CID 21412758
(1Z)-N-hydroxyhexanimidoyl chloride
CID 13031985
N-nonan-4-ylidenehydroxylamine;hydrochloride
CID 86742675

Frequently Asked Questions

What is the IUPAC name of N-tridecan-2-ylidenehydroxylamine?
The IUPAC name of N-tridecan-2-ylidenehydroxylamine (CID 74054313) is N-tridecan-2-ylidenehydroxylamine.
What is the SMILES notation for N-tridecan-2-ylidenehydroxylamine?
The canonical SMILES for N-tridecan-2-ylidenehydroxylamine is CCCCCCCCCCCC(C)=NO.
What is the InChIKey of N-tridecan-2-ylidenehydroxylamine?
The InChIKey is RISFWNKJKLLNOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-3-4-5-6-7-8-9-10-11-12-13(2)14-15/h15H,3-12H2,1-2H3.
What are the key properties of N-tridecan-2-ylidenehydroxylamine?
N-tridecan-2-ylidenehydroxylamine has a molecular weight of 213.36 g/mol, XLogP of 4.76, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tridecan-2-ylidenehydroxylamine is sourced from PubChem (CID 74054313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).