N-[(2R)-1,1-difluoropropan-2-yl]-5-azaspiro[2.4]heptane-5-carboxamide

C10H16F2N2O — CID 170193850

IUPACN-[(2R)-1,1-difluoropropan-2-yl]-5-azaspiro[2.4]heptane-5-carboxamide
SMILESC[C@@H](NC(=O)N1CCC2(CC2)C1)C(F)F
InChIInChI=1S/C10H16F2N2O/c1-7(8(11)12)13-9(15)14-5-4-10(6-14)2-3-10/h7-8H,2-6H2,1H3,(H,13,15)/t7-/m1/s1
InChIKeyZOLLAKWKESOWNY-SSDOTTSWSA-N
MW218.25 g/mol
LogP1.84
Rot. Bonds2

About N-[(2R)-1,1-difluoropropan-2-yl]-5-azaspiro[2.4]heptane-5-carboxamide

N-[(2R)-1,1-difluoropropan-2-yl]-5-azaspiro[2.4]heptane-5-carboxamide (PubChem CID 170193850) has the molecular formula C10H16F2N2O and a molecular weight of 218.25 g/mol. Its IUPAC name is N-[(2R)-1,1-difluoropropan-2-yl]-5-azaspiro[2.4]heptane-5-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1,1-difluoropropan-2-yl]-5-azaspiro[2.4]heptane-5-carboxamide
PubChem CID170193850
Molecular FormulaC10H16F2N2O
Molecular Weight218.25 g/mol
Exact Mass218.12
IUPAC NameN-[(2R)-1,1-difluoropropan-2-yl]-5-azaspiro[2.4]heptane-5-carboxamide
SMILESC[C@@H](NC(=O)N1CCC2(CC2)C1)C(F)F
InChIInChI=1S/C10H16F2N2O/c1-7(8(11)12)13-9(15)14-5-4-10(6-14)2-3-10/h7-8H,2-6H2,1H3,(H,13,15)/t7-/m1/s1
InChIKeyZOLLAKWKESOWNY-SSDOTTSWSA-N
XLogP1.84
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.25
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[(2R)-1,1-difluoropropan-2-yl]-5-azaspiro[2.4]heptane-5-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 N-[(2R)-1,1-difluoropropan-2-yl]-5-azaspiro[2.4]heptane-5-carboxamide?
The IUPAC name of N-[(2R)-1,1-difluoropropan-2-yl]-5-azaspiro[2.4]heptane-5-carboxamide (CID 170193850) is N-[(2R)-1,1-difluoropropan-2-yl]-5-azaspiro[2.4]heptane-5-carboxamide.
What is the SMILES notation for N-[(2R)-1,1-difluoropropan-2-yl]-5-azaspiro[2.4]heptane-5-carboxamide?
The canonical SMILES for N-[(2R)-1,1-difluoropropan-2-yl]-5-azaspiro[2.4]heptane-5-carboxamide is C[C@@H](NC(=O)N1CCC2(CC2)C1)C(F)F.
What is the InChIKey of N-[(2R)-1,1-difluoropropan-2-yl]-5-azaspiro[2.4]heptane-5-carboxamide?
The InChIKey is ZOLLAKWKESOWNY-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H16F2N2O/c1-7(8(11)12)13-9(15)14-5-4-10(6-14)2-3-10/h7-8H,2-6H2,1H3,(H,13,15)/t7-/m1/s1.
What are the key properties of N-[(2R)-1,1-difluoropropan-2-yl]-5-azaspiro[2.4]heptane-5-carboxamide?
N-[(2R)-1,1-difluoropropan-2-yl]-5-azaspiro[2.4]heptane-5-carboxamide has a molecular weight of 218.25 g/mol, XLogP of 1.84, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1,1-difluoropropan-2-yl]-5-azaspiro[2.4]heptane-5-carboxamide is sourced from PubChem (CID 170193850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).