N-(1-fluoropropan-2-yl)-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide

C14H24FNO2 — CID 143821240

IUPACN-(1-fluoropropan-2-yl)-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide
SMILESCCCN(C(=O)C1CC12CCOCC2)C(C)CF
InChIInChI=1S/C14H24FNO2/c1-3-6-16(11(2)10-15)13(17)12-9-14(12)4-7-18-8-5-14/h11-12H,3-10H2,1-2H3
InChIKeyXBRBHLFGXKUJPW-UHFFFAOYSA-N
MW257.35 g/mol
LogP2.40
Rot. Bonds5

About N-(1-fluoropropan-2-yl)-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide

N-(1-fluoropropan-2-yl)-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide (PubChem CID 143821240) has the molecular formula C14H24FNO2 and a molecular weight of 257.35 g/mol. Its IUPAC name is N-(1-fluoropropan-2-yl)-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide.

Molecular Properties

Compound NameN-(1-fluoropropan-2-yl)-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide
PubChem CID143821240
Molecular FormulaC14H24FNO2
Molecular Weight257.35 g/mol
Exact Mass257.18
IUPAC NameN-(1-fluoropropan-2-yl)-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide
SMILESCCCN(C(=O)C1CC12CCOCC2)C(C)CF
InChIInChI=1S/C14H24FNO2/c1-3-6-16(11(2)10-15)13(17)12-9-14(12)4-7-18-8-5-14/h11-12H,3-10H2,1-2H3
InChIKeyXBRBHLFGXKUJPW-UHFFFAOYSA-N
XLogP2.40
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.35
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-(1-fluoropropan-2-yl)-N-propyl-6-oxaspiro[2.5]octane-2-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-(1-fluoropropan-2-yl)-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide?
The IUPAC name of N-(1-fluoropropan-2-yl)-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide (CID 143821240) is N-(1-fluoropropan-2-yl)-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide.
What is the SMILES notation for N-(1-fluoropropan-2-yl)-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide?
The canonical SMILES for N-(1-fluoropropan-2-yl)-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide is CCCN(C(=O)C1CC12CCOCC2)C(C)CF.
What is the InChIKey of N-(1-fluoropropan-2-yl)-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide?
The InChIKey is XBRBHLFGXKUJPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24FNO2/c1-3-6-16(11(2)10-15)13(17)12-9-14(12)4-7-18-8-5-14/h11-12H,3-10H2,1-2H3.
What are the key properties of N-(1-fluoropropan-2-yl)-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide?
N-(1-fluoropropan-2-yl)-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide has a molecular weight of 257.35 g/mol, XLogP of 2.40, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-fluoropropan-2-yl)-N-propyl-6-oxaspiro[2.5]octane-2-carboxamide is sourced from PubChem (CID 143821240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).