2-fluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide

C7H12FNO2 — CID 175777541

IUPAC2-fluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide
SMILESO=C(CF)NCC1(CO)CC1
InChIInChI=1S/C7H12FNO2/c8-3-6(11)9-4-7(5-10)1-2-7/h10H,1-5H2,(H,9,11)
InChIKeyHOPQFQIBNNAPGB-UHFFFAOYSA-N
MW161.18 g/mol
LogP-0.16
Rot. Bonds4

About 2-fluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide

2-fluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide (PubChem CID 175777541) has the molecular formula C7H12FNO2 and a molecular weight of 161.18 g/mol. Its IUPAC name is 2-fluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide.

Molecular Properties

Compound Name2-fluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide
PubChem CID175777541
Molecular FormulaC7H12FNO2
Molecular Weight161.18 g/mol
Exact Mass161.09
IUPAC Name2-fluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide
SMILESO=C(CF)NCC1(CO)CC1
InChIInChI=1S/C7H12FNO2/c8-3-6(11)9-4-7(5-10)1-2-7/h10H,1-5H2,(H,9,11)
InChIKeyHOPQFQIBNNAPGB-UHFFFAOYSA-N
XLogP-0.16
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.18
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide?
The IUPAC name of 2-fluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide (CID 175777541) is 2-fluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide.
What is the SMILES notation for 2-fluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide?
The canonical SMILES for 2-fluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide is O=C(CF)NCC1(CO)CC1.
What is the InChIKey of 2-fluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide?
The InChIKey is HOPQFQIBNNAPGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12FNO2/c8-3-6(11)9-4-7(5-10)1-2-7/h10H,1-5H2,(H,9,11).
What are the key properties of 2-fluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide?
2-fluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide has a molecular weight of 161.18 g/mol, XLogP of -0.16, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]acetamide is sourced from PubChem (CID 175777541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).