2-(1-diazopropan-2-yl)furan

C7H8N2O — CID 119087241

IUPAC2-(1-diazopropan-2-yl)furan
SMILESCC(C=[N+]=[N-])c1ccco1
InChIInChI=1S/C7H8N2O/c1-6(5-9-8)7-3-2-4-10-7/h2-6H,1H3
InChIKeyGWZCCTUAQWHATR-UHFFFAOYSA-N
MW136.15 g/mol
LogP1.68
Rot. Bonds2

About 2-(1-diazopropan-2-yl)furan

2-(1-diazopropan-2-yl)furan (PubChem CID 119087241) has the molecular formula C7H8N2O and a molecular weight of 136.15 g/mol. Its IUPAC name is 2-(1-diazopropan-2-yl)furan.

Molecular Properties

Compound Name2-(1-diazopropan-2-yl)furan
PubChem CID119087241
Molecular FormulaC7H8N2O
Molecular Weight136.15 g/mol
Exact Mass136.06
IUPAC Name2-(1-diazopropan-2-yl)furan
SMILESCC(C=[N+]=[N-])c1ccco1
InChIInChI=1S/C7H8N2O/c1-6(5-9-8)7-3-2-4-10-7/h2-6H,1H3
InChIKeyGWZCCTUAQWHATR-UHFFFAOYSA-N
XLogP1.68
TPSA49.54 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.15
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

2-(furan-2-yl)propanethial
CID 54309432
2-(furan-2-yl)-3-methylbutanal
CID 579273
(S)-azido(furan-2-yl)methanol
CID 135057123
1-(furan-2-yl)pentane-1,3,4-triol
CID 175602784
1-(furan-2-yl)-2-methylbutane-1,3-diol
CID 72990739
N-[(1R)-1-(furan-2-yl)ethyl]but-3-en-2-amine
CID 107907535
2-(4-chloropentan-2-yl)furan
CID 64720798
(1S,3S)-1-(furan-2-yl)butane-1,3-diol
CID 46177371
N-(1-azidoethyl)furan-2-amine
CID 175019842
N-[1-(furan-2-yl)ethyl]prop-2-en-1-amine
CID 43177064
(1R,2R)-1,2-bis(furan-2-yl)ethane-1,2-diamine;hydrochloride
CID 156789139
(3R,4S)-4-[(1S)-1-(furan-2-yl)prop-2-enoxy]pent-1-en-3-ol
CID 11106585

Frequently Asked Questions

What is the IUPAC name of 2-(1-diazopropan-2-yl)furan?
The IUPAC name of 2-(1-diazopropan-2-yl)furan (CID 119087241) is 2-(1-diazopropan-2-yl)furan.
What is the SMILES notation for 2-(1-diazopropan-2-yl)furan?
The canonical SMILES for 2-(1-diazopropan-2-yl)furan is CC(C=[N+]=[N-])c1ccco1.
What is the InChIKey of 2-(1-diazopropan-2-yl)furan?
The InChIKey is GWZCCTUAQWHATR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O/c1-6(5-9-8)7-3-2-4-10-7/h2-6H,1H3.
What are the key properties of 2-(1-diazopropan-2-yl)furan?
2-(1-diazopropan-2-yl)furan has a molecular weight of 136.15 g/mol, XLogP of 1.68, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-diazopropan-2-yl)furan is sourced from PubChem (CID 119087241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).