[(2R)-1-[3-(difluoromethoxy)piperidin-1-yl]-1-oxopropan-2-yl]carbamic acid

C10H16F2N2O4 — CID 122669491

IUPAC[(2R)-1-[3-(difluoromethoxy)piperidin-1-yl]-1-oxopropan-2-yl]carbamic acid
SMILESC[C@@H](NC(=O)O)C(=O)N1CCCC(OC(F)F)C1
InChIInChI=1S/C10H16F2N2O4/c1-6(13-10(16)17)8(15)14-4-2-3-7(5-14)18-9(11)12/h6-7,9,13H,2-5H2,1H3,(H,16,17)/t6-,7?/m1/s1
InChIKeyMWTJUBWIPZSERK-ULUSZKPHSA-N
MW266.24 g/mol
LogP0.87
Rot. Bonds4

About [(2R)-1-[3-(difluoromethoxy)piperidin-1-yl]-1-oxopropan-2-yl]carbamic acid

[(2R)-1-[3-(difluoromethoxy)piperidin-1-yl]-1-oxopropan-2-yl]carbamic acid (PubChem CID 122669491) has the molecular formula C10H16F2N2O4 and a molecular weight of 266.24 g/mol. Its IUPAC name is [(2R)-1-[3-(difluoromethoxy)piperidin-1-yl]-1-oxopropan-2-yl]carbamic acid.

Molecular Properties

Compound Name[(2R)-1-[3-(difluoromethoxy)piperidin-1-yl]-1-oxopropan-2-yl]carbamic acid
PubChem CID122669491
Molecular FormulaC10H16F2N2O4
Molecular Weight266.24 g/mol
Exact Mass266.11
IUPAC Name[(2R)-1-[3-(difluoromethoxy)piperidin-1-yl]-1-oxopropan-2-yl]carbamic acid
SMILESC[C@@H](NC(=O)O)C(=O)N1CCCC(OC(F)F)C1
InChIInChI=1S/C10H16F2N2O4/c1-6(13-10(16)17)8(15)14-4-2-3-7(5-14)18-9(11)12/h6-7,9,13H,2-5H2,1H3,(H,16,17)/t6-,7?/m1/s1
InChIKeyMWTJUBWIPZSERK-ULUSZKPHSA-N
XLogP0.87
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.24
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [(2R)-1-[3-(difluoromethoxy)piperidin-1-yl]-1-oxopropan-2-yl]carbamic acid 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 [(2R)-1-[3-(difluoromethoxy)piperidin-1-yl]-1-oxopropan-2-yl]carbamic acid?
The IUPAC name of [(2R)-1-[3-(difluoromethoxy)piperidin-1-yl]-1-oxopropan-2-yl]carbamic acid (CID 122669491) is [(2R)-1-[3-(difluoromethoxy)piperidin-1-yl]-1-oxopropan-2-yl]carbamic acid.
What is the SMILES notation for [(2R)-1-[3-(difluoromethoxy)piperidin-1-yl]-1-oxopropan-2-yl]carbamic acid?
The canonical SMILES for [(2R)-1-[3-(difluoromethoxy)piperidin-1-yl]-1-oxopropan-2-yl]carbamic acid is C[C@@H](NC(=O)O)C(=O)N1CCCC(OC(F)F)C1.
What is the InChIKey of [(2R)-1-[3-(difluoromethoxy)piperidin-1-yl]-1-oxopropan-2-yl]carbamic acid?
The InChIKey is MWTJUBWIPZSERK-ULUSZKPHSA-N. The full InChI is InChI=1S/C10H16F2N2O4/c1-6(13-10(16)17)8(15)14-4-2-3-7(5-14)18-9(11)12/h6-7,9,13H,2-5H2,1H3,(H,16,17)/t6-,7?/m1/s1.
What are the key properties of [(2R)-1-[3-(difluoromethoxy)piperidin-1-yl]-1-oxopropan-2-yl]carbamic acid?
[(2R)-1-[3-(difluoromethoxy)piperidin-1-yl]-1-oxopropan-2-yl]carbamic acid has a molecular weight of 266.24 g/mol, XLogP of 0.87, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-[3-(difluoromethoxy)piperidin-1-yl]-1-oxopropan-2-yl]carbamic acid is sourced from PubChem (CID 122669491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).