N-(2-fluorobutylidene)hydroxylamine

C4H8FNO — CID 154368227

IUPACN-(2-fluorobutylidene)hydroxylamine
SMILESCCC(F)C=NO
InChIInChI=1S/C4H8FNO/c1-2-4(5)3-6-7/h3-4,7H,2H2,1H3
InChIKeyYSGHMPNFNPDCSD-UHFFFAOYSA-N
MW105.11 g/mol
LogP1.19
Rot. Bonds2

About N-(2-fluorobutylidene)hydroxylamine

N-(2-fluorobutylidene)hydroxylamine (PubChem CID 154368227) has the molecular formula C4H8FNO and a molecular weight of 105.11 g/mol. Its IUPAC name is N-(2-fluorobutylidene)hydroxylamine.

Molecular Properties

Compound NameN-(2-fluorobutylidene)hydroxylamine
PubChem CID154368227
Molecular FormulaC4H8FNO
Molecular Weight105.11 g/mol
Exact Mass105.06
IUPAC NameN-(2-fluorobutylidene)hydroxylamine
SMILESCCC(F)C=NO
InChIInChI=1S/C4H8FNO/c1-2-4(5)3-6-7/h3-4,7H,2H2,1H3
InChIKeyYSGHMPNFNPDCSD-UHFFFAOYSA-N
XLogP1.19
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.11
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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

(NE)-N-(2-ethylbutylidene)hydroxylamine
CID 5354129
(NZ)-N-[(2S)-2-methylbutylidene]hydroxylamine
CID 71448984
N-[2-[bis(1-hydroxyiminobutan-2-yl)-methylsilyl]butylidene]hydroxylamine
CID 173411551
(3S)-3-fluoropent-1-ene
CID 122210024
(NE)-N-(2-ethylhexylidene)hydroxylamine
CID 11252077
pentan-3-ol
CID 11428
pentan-3-ol;dihydrochloride
CID 141116397
(4Z,6R)-3,6-difluoro-2-methylocta-2,4-diene
CID 143497549
1-fluorobutan-2-ol
CID 13278453
(Z)-3-fluorooct-4-ene
CID 143337170
N-(2-methylundecylidene)hydroxylamine
CID 72729964
N-methylmethanamine;pentan-3-ol
CID 143532118

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorobutylidene)hydroxylamine?
The IUPAC name of N-(2-fluorobutylidene)hydroxylamine (CID 154368227) is N-(2-fluorobutylidene)hydroxylamine.
What is the SMILES notation for N-(2-fluorobutylidene)hydroxylamine?
The canonical SMILES for N-(2-fluorobutylidene)hydroxylamine is CCC(F)C=NO.
What is the InChIKey of N-(2-fluorobutylidene)hydroxylamine?
The InChIKey is YSGHMPNFNPDCSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8FNO/c1-2-4(5)3-6-7/h3-4,7H,2H2,1H3.
What are the key properties of N-(2-fluorobutylidene)hydroxylamine?
N-(2-fluorobutylidene)hydroxylamine has a molecular weight of 105.11 g/mol, XLogP of 1.19, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorobutylidene)hydroxylamine is sourced from PubChem (CID 154368227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).