N-[(5-propylfuran-2-yl)methylidene]hydroxylamine

C8H11NO2 — CID 71322162

IUPACN-[(5-propylfuran-2-yl)methylidene]hydroxylamine
SMILESCCCc1ccc(C=NO)o1
InChIInChI=1S/C8H11NO2/c1-2-3-7-4-5-8(11-7)6-9-10/h4-6,10H,2-3H2,1H3
InChIKeyAVOYHKBFKJUQDA-UHFFFAOYSA-N
MW153.18 g/mol
LogP2.04
Rot. Bonds3

About N-[(5-propylfuran-2-yl)methylidene]hydroxylamine

N-[(5-propylfuran-2-yl)methylidene]hydroxylamine (PubChem CID 71322162) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is N-[(5-propylfuran-2-yl)methylidene]hydroxylamine.

Molecular Properties

Compound NameN-[(5-propylfuran-2-yl)methylidene]hydroxylamine
PubChem CID71322162
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC NameN-[(5-propylfuran-2-yl)methylidene]hydroxylamine
SMILESCCCc1ccc(C=NO)o1
InChIInChI=1S/C8H11NO2/c1-2-3-7-4-5-8(11-7)6-9-10/h4-6,10H,2-3H2,1H3
InChIKeyAVOYHKBFKJUQDA-UHFFFAOYSA-N
XLogP2.04
TPSA45.73 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 52.04
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'}

Analyze N-[(5-propylfuran-2-yl)methylidene]hydroxylamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(5-propylfuran-2-yl)methylidene]hydroxylamine?
The IUPAC name of N-[(5-propylfuran-2-yl)methylidene]hydroxylamine (CID 71322162) is N-[(5-propylfuran-2-yl)methylidene]hydroxylamine.
What is the SMILES notation for N-[(5-propylfuran-2-yl)methylidene]hydroxylamine?
The canonical SMILES for N-[(5-propylfuran-2-yl)methylidene]hydroxylamine is CCCc1ccc(C=NO)o1.
What is the InChIKey of N-[(5-propylfuran-2-yl)methylidene]hydroxylamine?
The InChIKey is AVOYHKBFKJUQDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2/c1-2-3-7-4-5-8(11-7)6-9-10/h4-6,10H,2-3H2,1H3.
What are the key properties of N-[(5-propylfuran-2-yl)methylidene]hydroxylamine?
N-[(5-propylfuran-2-yl)methylidene]hydroxylamine has a molecular weight of 153.18 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-propylfuran-2-yl)methylidene]hydroxylamine is sourced from PubChem (CID 71322162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).