2-fluoro-N-[(2S)-2-hydroxypropyl]-1-methylcyclopropane-1-carboxamide

C8H14FNO2 — CID 131219527

IUPAC2-fluoro-N-[(2S)-2-hydroxypropyl]-1-methylcyclopropane-1-carboxamide
SMILESC[C@H](O)CNC(=O)C1(C)CC1F
InChIInChI=1S/C8H14FNO2/c1-5(11)4-10-7(12)8(2)3-6(8)9/h5-6,11H,3-4H2,1-2H3,(H,10,12)/t5-,6?,8?/m0/s1
InChIKeyKZZMIWIGLLSQGE-BHZOKHGKSA-N
MW175.20 g/mol
LogP0.23
Rot. Bonds3

About 2-fluoro-N-[(2S)-2-hydroxypropyl]-1-methylcyclopropane-1-carboxamide

2-fluoro-N-[(2S)-2-hydroxypropyl]-1-methylcyclopropane-1-carboxamide (PubChem CID 131219527) has the molecular formula C8H14FNO2 and a molecular weight of 175.20 g/mol. Its IUPAC name is 2-fluoro-N-[(2S)-2-hydroxypropyl]-1-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-fluoro-N-[(2S)-2-hydroxypropyl]-1-methylcyclopropane-1-carboxamide
PubChem CID131219527
Molecular FormulaC8H14FNO2
Molecular Weight175.20 g/mol
Exact Mass175.10
IUPAC Name2-fluoro-N-[(2S)-2-hydroxypropyl]-1-methylcyclopropane-1-carboxamide
SMILESC[C@H](O)CNC(=O)C1(C)CC1F
InChIInChI=1S/C8H14FNO2/c1-5(11)4-10-7(12)8(2)3-6(8)9/h5-6,11H,3-4H2,1-2H3,(H,10,12)/t5-,6?,8?/m0/s1
InChIKeyKZZMIWIGLLSQGE-BHZOKHGKSA-N
XLogP0.23
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.20
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-fluoro-N-[(2S)-2-hydroxypropyl]-1-methylcyclopropane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[(2S)-2-hydroxypropyl]-1-methylcyclopropane-1-carboxamide?
The IUPAC name of 2-fluoro-N-[(2S)-2-hydroxypropyl]-1-methylcyclopropane-1-carboxamide (CID 131219527) is 2-fluoro-N-[(2S)-2-hydroxypropyl]-1-methylcyclopropane-1-carboxamide.
What is the SMILES notation for 2-fluoro-N-[(2S)-2-hydroxypropyl]-1-methylcyclopropane-1-carboxamide?
The canonical SMILES for 2-fluoro-N-[(2S)-2-hydroxypropyl]-1-methylcyclopropane-1-carboxamide is C[C@H](O)CNC(=O)C1(C)CC1F.
What is the InChIKey of 2-fluoro-N-[(2S)-2-hydroxypropyl]-1-methylcyclopropane-1-carboxamide?
The InChIKey is KZZMIWIGLLSQGE-BHZOKHGKSA-N. The full InChI is InChI=1S/C8H14FNO2/c1-5(11)4-10-7(12)8(2)3-6(8)9/h5-6,11H,3-4H2,1-2H3,(H,10,12)/t5-,6?,8?/m0/s1.
What are the key properties of 2-fluoro-N-[(2S)-2-hydroxypropyl]-1-methylcyclopropane-1-carboxamide?
2-fluoro-N-[(2S)-2-hydroxypropyl]-1-methylcyclopropane-1-carboxamide has a molecular weight of 175.20 g/mol, XLogP of 0.23, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[(2S)-2-hydroxypropyl]-1-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 131219527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).