N-methyl-N-[(Z)-prop-1-enyl]hydroxylamine

C4H9NO — CID 144947013

IUPACN-methyl-N-[(Z)-prop-1-enyl]hydroxylamine
SMILESC/C=C\N(C)O
InChIInChI=1S/C4H9NO/c1-3-4-5(2)6/h3-4,6H,1-2H3/b4-3-
InChIKeyWISQMEBWEIRZAL-ARJAWSKDSA-N
MW87.12 g/mol
LogP0.84
Rot. Bonds1

About N-methyl-N-[(Z)-prop-1-enyl]hydroxylamine

N-methyl-N-[(Z)-prop-1-enyl]hydroxylamine (PubChem CID 144947013) has the molecular formula C4H9NO and a molecular weight of 87.12 g/mol. Its IUPAC name is N-methyl-N-[(Z)-prop-1-enyl]hydroxylamine.

Molecular Properties

Compound NameN-methyl-N-[(Z)-prop-1-enyl]hydroxylamine
PubChem CID144947013
Molecular FormulaC4H9NO
Molecular Weight87.12 g/mol
Exact Mass87.07
IUPAC NameN-methyl-N-[(Z)-prop-1-enyl]hydroxylamine
SMILESC/C=C\N(C)O
InChIInChI=1S/C4H9NO/c1-3-4-5(2)6/h3-4,6H,1-2H3/b4-3-
InChIKeyWISQMEBWEIRZAL-ARJAWSKDSA-N
XLogP0.84
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50087.12
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(Z)-prop-1-enyl]hydroxylamine?
The IUPAC name of N-methyl-N-[(Z)-prop-1-enyl]hydroxylamine (CID 144947013) is N-methyl-N-[(Z)-prop-1-enyl]hydroxylamine.
What is the SMILES notation for N-methyl-N-[(Z)-prop-1-enyl]hydroxylamine?
The canonical SMILES for N-methyl-N-[(Z)-prop-1-enyl]hydroxylamine is C/C=C\N(C)O.
What is the InChIKey of N-methyl-N-[(Z)-prop-1-enyl]hydroxylamine?
The InChIKey is WISQMEBWEIRZAL-ARJAWSKDSA-N. The full InChI is InChI=1S/C4H9NO/c1-3-4-5(2)6/h3-4,6H,1-2H3/b4-3-.
What are the key properties of N-methyl-N-[(Z)-prop-1-enyl]hydroxylamine?
N-methyl-N-[(Z)-prop-1-enyl]hydroxylamine has a molecular weight of 87.12 g/mol, XLogP of 0.84, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(Z)-prop-1-enyl]hydroxylamine is sourced from PubChem (CID 144947013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).