(NZ)-N-[(1-methylpyrrolidin-2-yl)methylidene]hydroxylamine

C6H12N2O — CID 91392408

IUPAC(NZ)-N-[(1-methylpyrrolidin-2-yl)methylidene]hydroxylamine
SMILESCN1CCCC1/C=N\O
InChIInChI=1S/C6H12N2O/c1-8-4-2-3-6(8)5-7-9/h5-6,9H,2-4H2,1H3/b7-5-
InChIKeyGHCSNLPPUCLSFV-ALCCZGGFSA-N
MW128.18 g/mol
LogP0.54
Rot. Bonds1

About (NZ)-N-[(1-methylpyrrolidin-2-yl)methylidene]hydroxylamine

(NZ)-N-[(1-methylpyrrolidin-2-yl)methylidene]hydroxylamine (PubChem CID 91392408) has the molecular formula C6H12N2O and a molecular weight of 128.18 g/mol. Its IUPAC name is (NZ)-N-[(1-methylpyrrolidin-2-yl)methylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[(1-methylpyrrolidin-2-yl)methylidene]hydroxylamine
PubChem CID91392408
Molecular FormulaC6H12N2O
Molecular Weight128.18 g/mol
Exact Mass128.09
IUPAC Name(NZ)-N-[(1-methylpyrrolidin-2-yl)methylidene]hydroxylamine
SMILESCN1CCCC1/C=N\O
InChIInChI=1S/C6H12N2O/c1-8-4-2-3-6(8)5-7-9/h5-6,9H,2-4H2,1H3/b7-5-
InChIKeyGHCSNLPPUCLSFV-ALCCZGGFSA-N
XLogP0.54
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.18
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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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Related Compounds

1-[(2S)-1-methylpyrrolidin-2-yl]-N-propan-2-yloxymethanimine
CID 90981030
(2S)-2-ethenyl-1-methylpyrrolidine;propane
CID 172577719
4-methyl-3-[(1-methylpyrrolidin-2-yl)methylideneamino]pent-2-en-2-olate
CID 58783205
(2S)-1-methyl-2-[(E)-prop-1-enyl]pyrrolidine
CID 155396519
(E)-2-[(2R)-1-methylpiperidin-2-yl]ethenol
CID 163529259
(Z)-2-fluoro-3-(1-methylpyrrolidin-2-yl)prop-2-enoic acid
CID 170967279
(2R)-2-[(E)-2-methoxyethenyl]-1-methylpyrrolidine
CID 126669652
(Z)-3-(1-methylpyrrolidin-2-yl)prop-2-en-1-amine
CID 117265759
(2R)-2-ethyl-1-methylpyrrolidine;hydrofluoride
CID 162730747
(Z)-4-(1-methylpyrrolidin-2-yl)but-3-enoic acid
CID 117267590
(E)-4-methyl-1-[(2S)-1-methylpyrrolidin-2-yl]hex-1-en-3-one
CID 137471242
(2R)-3-(1-methylpyrrolidin-2-yl)propane-1,2-diol
CID 142317689

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[(1-methylpyrrolidin-2-yl)methylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[(1-methylpyrrolidin-2-yl)methylidene]hydroxylamine (CID 91392408) is (NZ)-N-[(1-methylpyrrolidin-2-yl)methylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[(1-methylpyrrolidin-2-yl)methylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[(1-methylpyrrolidin-2-yl)methylidene]hydroxylamine is CN1CCCC1/C=N\O.
What is the InChIKey of (NZ)-N-[(1-methylpyrrolidin-2-yl)methylidene]hydroxylamine?
The InChIKey is GHCSNLPPUCLSFV-ALCCZGGFSA-N. The full InChI is InChI=1S/C6H12N2O/c1-8-4-2-3-6(8)5-7-9/h5-6,9H,2-4H2,1H3/b7-5-.
What are the key properties of (NZ)-N-[(1-methylpyrrolidin-2-yl)methylidene]hydroxylamine?
(NZ)-N-[(1-methylpyrrolidin-2-yl)methylidene]hydroxylamine has a molecular weight of 128.18 g/mol, XLogP of 0.54, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[(1-methylpyrrolidin-2-yl)methylidene]hydroxylamine is sourced from PubChem (CID 91392408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).