(NZ)-N-[(2S)-2-methylbutylidene]hydroxylamine

C5H11NO — CID 71448984

IUPAC(NZ)-N-[(2S)-2-methylbutylidene]hydroxylamine
SMILESCC[C@H](C)/C=N\O
InChIInChI=1S/C5H11NO/c1-3-5(2)4-6-7/h4-5,7H,3H2,1-2H3/b6-4-/t5-/m0/s1
InChIKeySEWWFHKIKWFJNV-YIWIKUPCSA-N
MW101.15 g/mol
LogP1.49
Rot. Bonds2

About (NZ)-N-[(2S)-2-methylbutylidene]hydroxylamine

(NZ)-N-[(2S)-2-methylbutylidene]hydroxylamine (PubChem CID 71448984) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is (NZ)-N-[(2S)-2-methylbutylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[(2S)-2-methylbutylidene]hydroxylamine
PubChem CID71448984
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Name(NZ)-N-[(2S)-2-methylbutylidene]hydroxylamine
SMILESCC[C@H](C)/C=N\O
InChIInChI=1S/C5H11NO/c1-3-5(2)4-6-7/h4-5,7H,3H2,1-2H3/b6-4-/t5-/m0/s1
InChIKeySEWWFHKIKWFJNV-YIWIKUPCSA-N
XLogP1.49
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 51.49
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-[(2S)-2-methylbutylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[(2S)-2-methylbutylidene]hydroxylamine (CID 71448984) is (NZ)-N-[(2S)-2-methylbutylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[(2S)-2-methylbutylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[(2S)-2-methylbutylidene]hydroxylamine is CC[C@H](C)/C=N\O.
What is the InChIKey of (NZ)-N-[(2S)-2-methylbutylidene]hydroxylamine?
The InChIKey is SEWWFHKIKWFJNV-YIWIKUPCSA-N. The full InChI is InChI=1S/C5H11NO/c1-3-5(2)4-6-7/h4-5,7H,3H2,1-2H3/b6-4-/t5-/m0/s1.
What are the key properties of (NZ)-N-[(2S)-2-methylbutylidene]hydroxylamine?
(NZ)-N-[(2S)-2-methylbutylidene]hydroxylamine has a molecular weight of 101.15 g/mol, XLogP of 1.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[(2S)-2-methylbutylidene]hydroxylamine is sourced from PubChem (CID 71448984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).