3-(2-fluorophenyl)-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)benzamide

C22H25FN2O2 — CID 131925747

IUPAC3-(2-fluorophenyl)-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)benzamide
SMILESO=C(NCC1CC2(CCNCC2)CO1)c1cccc(-c2ccccc2F)c1
InChIInChI=1S/C22H25FN2O2/c23-20-7-2-1-6-19(20)16-4-3-5-17(12-16)21(26)25-14-18-13-22(15-27-18)8-10-24-11-9-22/h1-7,12,18,24H,8-11,13-15H2,(H,25,26)
InChIKeyDWHPRPAAUIEDBD-UHFFFAOYSA-N
MW368.45 g/mol
LogP3.38
Rot. Bonds4

About 3-(2-fluorophenyl)-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)benzamide

3-(2-fluorophenyl)-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)benzamide (PubChem CID 131925747) has the molecular formula C22H25FN2O2 and a molecular weight of 368.45 g/mol. Its IUPAC name is 3-(2-fluorophenyl)-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)benzamide.

Molecular Properties

Compound Name3-(2-fluorophenyl)-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)benzamide
PubChem CID131925747
Molecular FormulaC22H25FN2O2
Molecular Weight368.45 g/mol
Exact Mass368.19
IUPAC Name3-(2-fluorophenyl)-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)benzamide
SMILESO=C(NCC1CC2(CCNCC2)CO1)c1cccc(-c2ccccc2F)c1
InChIInChI=1S/C22H25FN2O2/c23-20-7-2-1-6-19(20)16-4-3-5-17(12-16)21(26)25-14-18-13-22(15-27-18)8-10-24-11-9-22/h1-7,12,18,24H,8-11,13-15H2,(H,25,26)
InChIKeyDWHPRPAAUIEDBD-UHFFFAOYSA-N
XLogP3.38
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.45
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(2-fluorophenyl)-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)benzamide with MolForge

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

Launch Full Analysis

Related Compounds

2-hydroxy-6-methoxy-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)benzamide;hydrochloride
CID 154918040
6-chloro-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)-2-oxochromene-3-carboxamide
CID 171909285
2-hydroxy-4-methoxy-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)benzamide;hydrochloride
CID 154917317
N-(2-oxa-7-azaspiro[4.4]nonan-3-ylmethyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
CID 167774200
tert-butyl N-[[(3R)-2-oxa-8-azaspiro[4.5]decan-3-yl]methyl]carbamate
CID 99933957
3-(2-fluorophenyl)-N-[2-(2-oxopyrrolidin-1-yl)ethyl]benzamide
CID 50959619
3-(3-fluoro-2-hydroxyphenyl)-N-[4-(oxolan-2-yl)butyl]benzamide
CID 118788734
N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-3-(2-fluorophenyl)benzamide
CID 131926590
3-(3-fluoro-4-pyridinyl)-N-[(3-methyloxetan-3-yl)methyl]benzamide
CID 118787820
5-(4-chlorophenyl)-3-(2-oxa-8-azaspiro[4.5]decan-3-ylmethylamino)-1,2-oxazole-4-carboxylic acid
CID 135109736
3-(2-fluorophenyl)-N-(morpholin-2-ylmethyl)-1H-pyrazole-5-carboxamide
CID 167869800
2-oxa-8-azaspiro[4.5]decan-3-ylmethanol
CID 57368663

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenyl)-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)benzamide?
The IUPAC name of 3-(2-fluorophenyl)-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)benzamide (CID 131925747) is 3-(2-fluorophenyl)-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)benzamide.
What is the SMILES notation for 3-(2-fluorophenyl)-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)benzamide?
The canonical SMILES for 3-(2-fluorophenyl)-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)benzamide is O=C(NCC1CC2(CCNCC2)CO1)c1cccc(-c2ccccc2F)c1.
What is the InChIKey of 3-(2-fluorophenyl)-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)benzamide?
The InChIKey is DWHPRPAAUIEDBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25FN2O2/c23-20-7-2-1-6-19(20)16-4-3-5-17(12-16)21(26)25-14-18-13-22(15-27-18)8-10-24-11-9-22/h1-7,12,18,24H,8-11,13-15H2,(H,25,26).
What are the key properties of 3-(2-fluorophenyl)-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)benzamide?
3-(2-fluorophenyl)-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)benzamide has a molecular weight of 368.45 g/mol, XLogP of 3.38, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenyl)-N-(2-oxa-8-azaspiro[4.5]decan-3-ylmethyl)benzamide is sourced from PubChem (CID 131925747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).