N-(1-fluoro-2-methylpropan-2-yl)formamide

C5H10FNO — CID 14806739

IUPACN-(1-fluoro-2-methylpropan-2-yl)formamide
SMILESCC(C)(CF)NC=O
InChIInChI=1S/C5H10FNO/c1-5(2,3-6)7-4-8/h4H,3H2,1-2H3,(H,7,8)
InChIKeyTZACTCDWFSNPGU-UHFFFAOYSA-N
MW119.14 g/mol
LogP0.48
Rot. Bonds3

About N-(1-fluoro-2-methylpropan-2-yl)formamide

N-(1-fluoro-2-methylpropan-2-yl)formamide (PubChem CID 14806739) has the molecular formula C5H10FNO and a molecular weight of 119.14 g/mol. Its IUPAC name is N-(1-fluoro-2-methylpropan-2-yl)formamide.

Molecular Properties

Compound NameN-(1-fluoro-2-methylpropan-2-yl)formamide
PubChem CID14806739
Molecular FormulaC5H10FNO
Molecular Weight119.14 g/mol
Exact Mass119.07
IUPAC NameN-(1-fluoro-2-methylpropan-2-yl)formamide
SMILESCC(C)(CF)NC=O
InChIInChI=1S/C5H10FNO/c1-5(2,3-6)7-4-8/h4H,3H2,1-2H3,(H,7,8)
InChIKeyTZACTCDWFSNPGU-UHFFFAOYSA-N
XLogP0.48
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.14
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(1-fluoro-2-methylpropan-2-yl)formamide?
The IUPAC name of N-(1-fluoro-2-methylpropan-2-yl)formamide (CID 14806739) is N-(1-fluoro-2-methylpropan-2-yl)formamide.
What is the SMILES notation for N-(1-fluoro-2-methylpropan-2-yl)formamide?
The canonical SMILES for N-(1-fluoro-2-methylpropan-2-yl)formamide is CC(C)(CF)NC=O.
What is the InChIKey of N-(1-fluoro-2-methylpropan-2-yl)formamide?
The InChIKey is TZACTCDWFSNPGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10FNO/c1-5(2,3-6)7-4-8/h4H,3H2,1-2H3,(H,7,8).
What are the key properties of N-(1-fluoro-2-methylpropan-2-yl)formamide?
N-(1-fluoro-2-methylpropan-2-yl)formamide has a molecular weight of 119.14 g/mol, XLogP of 0.48, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-fluoro-2-methylpropan-2-yl)formamide is sourced from PubChem (CID 14806739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).