N-(1-dibenzofuran-2-ylethyl)hydroxylamine

C14H13NO2 — CID 14234879

IUPACN-(1-dibenzofuran-2-ylethyl)hydroxylamine
SMILESCC(NO)c1ccc2oc3ccccc3c2c1
InChIInChI=1S/C14H13NO2/c1-9(15-16)10-6-7-14-12(8-10)11-4-2-3-5-13(11)17-14/h2-9,15-16H,1H3
InChIKeyLWXVPCZMKBRXKQ-UHFFFAOYSA-N
MW227.26 g/mol
LogP3.63
Rot. Bonds2

About N-(1-dibenzofuran-2-ylethyl)hydroxylamine

N-(1-dibenzofuran-2-ylethyl)hydroxylamine (PubChem CID 14234879) has the molecular formula C14H13NO2 and a molecular weight of 227.26 g/mol. Its IUPAC name is N-(1-dibenzofuran-2-ylethyl)hydroxylamine.

Molecular Properties

Compound NameN-(1-dibenzofuran-2-ylethyl)hydroxylamine
PubChem CID14234879
Molecular FormulaC14H13NO2
Molecular Weight227.26 g/mol
Exact Mass227.09
IUPAC NameN-(1-dibenzofuran-2-ylethyl)hydroxylamine
SMILESCC(NO)c1ccc2oc3ccccc3c2c1
InChIInChI=1S/C14H13NO2/c1-9(15-16)10-6-7-14-12(8-10)11-4-2-3-5-13(11)17-14/h2-9,15-16H,1H3
InChIKeyLWXVPCZMKBRXKQ-UHFFFAOYSA-N
XLogP3.63
TPSA45.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(1S)-1-dibenzofuran-2-ylethanol
CID 82758937
1-dibenzofuran-2-ylethanamine;hydrochloride
CID 13012128
2-[(1S)-1-chloroethyl]dibenzofuran
CID 129370090
(S)-N-[(1R)-1-dibenzofuran-2-ylethyl]-2-methylpropane-2-sulfinamide
CID 176891324
2-dibenzofuran-2-yl-N-methylpropanamide
CID 163614988
1-dibenzofuran-2-yl-3-methylbutan-1-amine
CID 43100935
N-[(1R)-1-dibenzofuran-2-ylethyl]pyrazin-2-amine
CID 170789964
1-dibenzofuran-2-yl-2-methylpentan-1-ol
CID 63426339
1-dibenzofuran-2-ylprop-2-en-1-ol
CID 171366955
1-dibenzofuran-2-ylhexan-1-ol
CID 63426377
1-dibenzofuran-2-ylheptan-1-ol
CID 114753371
1-dibenzofuran-2-yl-1-(furan-2-yl)-N-methylmethanamine
CID 43482139

Frequently Asked Questions

What is the IUPAC name of N-(1-dibenzofuran-2-ylethyl)hydroxylamine?
The IUPAC name of N-(1-dibenzofuran-2-ylethyl)hydroxylamine (CID 14234879) is N-(1-dibenzofuran-2-ylethyl)hydroxylamine.
What is the SMILES notation for N-(1-dibenzofuran-2-ylethyl)hydroxylamine?
The canonical SMILES for N-(1-dibenzofuran-2-ylethyl)hydroxylamine is CC(NO)c1ccc2oc3ccccc3c2c1.
What is the InChIKey of N-(1-dibenzofuran-2-ylethyl)hydroxylamine?
The InChIKey is LWXVPCZMKBRXKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO2/c1-9(15-16)10-6-7-14-12(8-10)11-4-2-3-5-13(11)17-14/h2-9,15-16H,1H3.
What are the key properties of N-(1-dibenzofuran-2-ylethyl)hydroxylamine?
N-(1-dibenzofuran-2-ylethyl)hydroxylamine has a molecular weight of 227.26 g/mol, XLogP of 3.63, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-dibenzofuran-2-ylethyl)hydroxylamine is sourced from PubChem (CID 14234879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).