N-[[4-fluoro-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidin-4-yl]methyl]oxolane-3-carboxamide

C19H32FN3O3 — CID 166601390

IUPACN-[[4-fluoro-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidin-4-yl]methyl]oxolane-3-carboxamide
SMILESCC1CCN(C(=O)CN2CCC(F)(CNC(=O)C3CCOC3)CC2)CC1
InChIInChI=1S/C19H32FN3O3/c1-15-2-7-23(8-3-15)17(24)12-22-9-5-19(20,6-10-22)14-21-18(25)16-4-11-26-13-16/h15-16H,2-14H2,1H3,(H,21,25)
InChIKeyVHNAVMTXYNEDLM-UHFFFAOYSA-N
MW369.48 g/mol
LogP1.20
Rot. Bonds5

About N-[[4-fluoro-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidin-4-yl]methyl]oxolane-3-carboxamide

N-[[4-fluoro-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidin-4-yl]methyl]oxolane-3-carboxamide (PubChem CID 166601390) has the molecular formula C19H32FN3O3 and a molecular weight of 369.48 g/mol. Its IUPAC name is N-[[4-fluoro-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidin-4-yl]methyl]oxolane-3-carboxamide.

Molecular Properties

Compound NameN-[[4-fluoro-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidin-4-yl]methyl]oxolane-3-carboxamide
PubChem CID166601390
Molecular FormulaC19H32FN3O3
Molecular Weight369.48 g/mol
Exact Mass369.24
IUPAC NameN-[[4-fluoro-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidin-4-yl]methyl]oxolane-3-carboxamide
SMILESCC1CCN(C(=O)CN2CCC(F)(CNC(=O)C3CCOC3)CC2)CC1
InChIInChI=1S/C19H32FN3O3/c1-15-2-7-23(8-3-15)17(24)12-22-9-5-19(20,6-10-22)14-21-18(25)16-4-11-26-13-16/h15-16H,2-14H2,1H3,(H,21,25)
InChIKeyVHNAVMTXYNEDLM-UHFFFAOYSA-N
XLogP1.20
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.48
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[4-fluoro-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidin-4-yl]methyl]oxolane-3-carboxamide with MolForge

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Related Compounds

N-[[4-fluoro-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidin-4-yl]methyl]-2,2-dimethylpropanamide
CID 165433149
N-[[4-fluoro-1-[(2-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]methyl]oxolane-3-carboxamide
CID 166600641
N-[[4-fluoro-1-[(5-propan-2-yl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]methyl]oxolane-3-carboxamide
CID 166600864
N-[[4-fluoro-1-[(3-methyl-1,2-oxazol-5-yl)methyl]piperidin-4-yl]methyl]oxolane-3-carboxamide
CID 166600643
N-[[1-(5-bromopyrimidin-2-yl)-4-fluoropiperidin-4-yl]methyl]oxolane-3-carboxamide
CID 165432283
N-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidine-4-carboxamide
CID 42542173
N-[[1-(4-methylpiperidin-1-yl)sulfonylpiperidin-4-yl]methyl]oxolane-3-carboxamide
CID 131907956
N-[[4-fluoro-1-[3-(methoxymethyl)-1,2,4-thiadiazol-5-yl]piperidin-4-yl]methyl]oxolane-3-carboxamide
CID 166600992
N-[[4-fluoro-1-(9-methylpurin-6-yl)piperidin-4-yl]methyl]oxolane-3-carboxamide
CID 166601069
2-(4-methylpiperidin-1-yl)-1-pyrrolidin-1-ylethanone
CID 39903910
N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]oxolane-3-carboxamide
CID 107301644
N-[[4-fluoro-1-[6-(trifluoromethyl)-3-pyridinyl]piperidin-4-yl]methyl]oxolane-3-carboxamide
CID 165432188

Frequently Asked Questions

What is the IUPAC name of N-[[4-fluoro-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidin-4-yl]methyl]oxolane-3-carboxamide?
The IUPAC name of N-[[4-fluoro-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidin-4-yl]methyl]oxolane-3-carboxamide (CID 166601390) is N-[[4-fluoro-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidin-4-yl]methyl]oxolane-3-carboxamide.
What is the SMILES notation for N-[[4-fluoro-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidin-4-yl]methyl]oxolane-3-carboxamide?
The canonical SMILES for N-[[4-fluoro-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidin-4-yl]methyl]oxolane-3-carboxamide is CC1CCN(C(=O)CN2CCC(F)(CNC(=O)C3CCOC3)CC2)CC1.
What is the InChIKey of N-[[4-fluoro-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidin-4-yl]methyl]oxolane-3-carboxamide?
The InChIKey is VHNAVMTXYNEDLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32FN3O3/c1-15-2-7-23(8-3-15)17(24)12-22-9-5-19(20,6-10-22)14-21-18(25)16-4-11-26-13-16/h15-16H,2-14H2,1H3,(H,21,25).
What are the key properties of N-[[4-fluoro-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidin-4-yl]methyl]oxolane-3-carboxamide?
N-[[4-fluoro-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidin-4-yl]methyl]oxolane-3-carboxamide has a molecular weight of 369.48 g/mol, XLogP of 1.20, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-fluoro-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperidin-4-yl]methyl]oxolane-3-carboxamide is sourced from PubChem (CID 166601390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).