N-(3-cyclopentyloxy-4-methoxyphenyl)-4-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carboxamide

C22H31N3O5 — CID 3857414

IUPACN-(3-cyclopentyloxy-4-methoxyphenyl)-4-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carboxamide
SMILESCOc1ccc(NC(=O)N2CCC(N3C(=O)OCC3C)CC2)cc1OC1CCCC1
InChIInChI=1S/C22H31N3O5/c1-15-14-29-22(27)25(15)17-9-11-24(12-10-17)21(26)23-16-7-8-19(28-2)20(13-16)30-18-5-3-4-6-18/h7-8,13,15,17-18H,3-6,9-12,14H2,1-2H3,(H,23,26)
InChIKeyHKLUUWXVRFNFIW-UHFFFAOYSA-N
MW417.51 g/mol
LogP3.85
Rot. Bonds5

About N-(3-cyclopentyloxy-4-methoxyphenyl)-4-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carboxamide

N-(3-cyclopentyloxy-4-methoxyphenyl)-4-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carboxamide (PubChem CID 3857414) has the molecular formula C22H31N3O5 and a molecular weight of 417.51 g/mol. Its IUPAC name is N-(3-cyclopentyloxy-4-methoxyphenyl)-4-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(3-cyclopentyloxy-4-methoxyphenyl)-4-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carboxamide
PubChem CID3857414
Molecular FormulaC22H31N3O5
Molecular Weight417.51 g/mol
Exact Mass417.23
IUPAC NameN-(3-cyclopentyloxy-4-methoxyphenyl)-4-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carboxamide
SMILESCOc1ccc(NC(=O)N2CCC(N3C(=O)OCC3C)CC2)cc1OC1CCCC1
InChIInChI=1S/C22H31N3O5/c1-15-14-29-22(27)25(15)17-9-11-24(12-10-17)21(26)23-16-7-8-19(28-2)20(13-16)30-18-5-3-4-6-18/h7-8,13,15,17-18H,3-6,9-12,14H2,1-2H3,(H,23,26)
InChIKeyHKLUUWXVRFNFIW-UHFFFAOYSA-N
XLogP3.85
TPSA80.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.51
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(3-cyclopentyloxy-4-methoxyphenyl)-4-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carboxamide with MolForge

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Related Compounds

N-(3-cyclopentyloxy-4-methoxyphenyl)-4-(4-ethyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carboxamide
CID 3847853
N-(3-cyclopentyloxy-4-methoxyphenyl)-4-[2-oxo-5-(phenoxymethyl)-1,3-oxazolidin-3-yl]piperidine-1-carboxamide
CID 5006435
N-(3-cyclopentyloxy-4-methoxyphenyl)-2-oxo-2-thiomorpholin-4-ylacetamide
CID 97063830
N-(3-cyclopentyloxy-4-methoxyphenyl)furan-3-carboxamide
CID 31872175
N-(3-cyclopentyloxy-4-methoxyphenyl)oxolane-3-carboxamide
CID 51094450
(2S)-N-(3,4-dimethoxyphenyl)-2-methylpiperidine-1-carboxamide
CID 1474768
N-(5-chloro-2-methoxyphenyl)-4-(4-ethyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carboxamide
CID 3850323
methyl 2-[(3-cyclopentyloxy-4-methoxyphenyl)carbamoyl]benzoate
CID 19428226
N-(5-chloro-2-methoxyphenyl)-4-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]piperidine-1-carboxamide
CID 74225372
1-(3-cyclopentyloxy-4-methoxyphenyl)-3-methylthiourea
CID 75414342
2-chloro-N-(3-cyclopentyloxy-4-methoxyphenyl)-4,5-difluorobenzamide
CID 31870921
2,4-dichloro-N-(3-cyclopentyloxy-4-methoxyphenyl)-5-fluorobenzamide
CID 31871992

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopentyloxy-4-methoxyphenyl)-4-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carboxamide?
The IUPAC name of N-(3-cyclopentyloxy-4-methoxyphenyl)-4-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carboxamide (CID 3857414) is N-(3-cyclopentyloxy-4-methoxyphenyl)-4-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carboxamide.
What is the SMILES notation for N-(3-cyclopentyloxy-4-methoxyphenyl)-4-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carboxamide?
The canonical SMILES for N-(3-cyclopentyloxy-4-methoxyphenyl)-4-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carboxamide is COc1ccc(NC(=O)N2CCC(N3C(=O)OCC3C)CC2)cc1OC1CCCC1.
What is the InChIKey of N-(3-cyclopentyloxy-4-methoxyphenyl)-4-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carboxamide?
The InChIKey is HKLUUWXVRFNFIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H31N3O5/c1-15-14-29-22(27)25(15)17-9-11-24(12-10-17)21(26)23-16-7-8-19(28-2)20(13-16)30-18-5-3-4-6-18/h7-8,13,15,17-18H,3-6,9-12,14H2,1-2H3,(H,23,26).
What are the key properties of N-(3-cyclopentyloxy-4-methoxyphenyl)-4-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carboxamide?
N-(3-cyclopentyloxy-4-methoxyphenyl)-4-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carboxamide has a molecular weight of 417.51 g/mol, XLogP of 3.85, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopentyloxy-4-methoxyphenyl)-4-(4-methyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carboxamide is sourced from PubChem (CID 3857414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).