N-cyclopentyl-4-methoxy-1-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide

C24H33N3O4 — CID 154571106

IUPACN-cyclopentyl-4-methoxy-1-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide
SMILESCOc1ccccc1-c1nc(CN2CCC(OC)(C(=O)NC3CCCC3)CC2)c(C)o1
InChIInChI=1S/C24H33N3O4/c1-17-20(26-22(31-17)19-10-6-7-11-21(19)29-2)16-27-14-12-24(30-3,13-15-27)23(28)25-18-8-4-5-9-18/h6-7,10-11,18H,4-5,8-9,12-16H2,1-3H3,(H,25,28)
InChIKeyBDSVGXGIZZBWTP-UHFFFAOYSA-N
MW427.55 g/mol
LogP3.70
Rot. Bonds7

About N-cyclopentyl-4-methoxy-1-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide

N-cyclopentyl-4-methoxy-1-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide (PubChem CID 154571106) has the molecular formula C24H33N3O4 and a molecular weight of 427.55 g/mol. Its IUPAC name is N-cyclopentyl-4-methoxy-1-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-methoxy-1-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide
PubChem CID154571106
Molecular FormulaC24H33N3O4
Molecular Weight427.55 g/mol
Exact Mass427.25
IUPAC NameN-cyclopentyl-4-methoxy-1-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide
SMILESCOc1ccccc1-c1nc(CN2CCC(OC)(C(=O)NC3CCCC3)CC2)c(C)o1
InChIInChI=1S/C24H33N3O4/c1-17-20(26-22(31-17)19-10-6-7-11-21(19)29-2)16-27-14-12-24(30-3,13-15-27)23(28)25-18-8-4-5-9-18/h6-7,10-11,18H,4-5,8-9,12-16H2,1-3H3,(H,25,28)
InChIKeyBDSVGXGIZZBWTP-UHFFFAOYSA-N
XLogP3.70
TPSA76.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.55
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[1-[[2-(2-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-4-yl]acetamide
CID 56743559
2-(2-methoxyphenyl)-5-methyl-4-(piperazin-1-ylmethyl)-1,3-oxazole
CID 46344229
2-(2-ethoxyphenyl)-4-[(4-methoxypiperidin-1-yl)methyl]-5-methyl-1,3-oxazole
CID 25491864
1-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-9-methyl-1,9-diazaspiro[4.5]decan-10-one
CID 163312463
N-cyclopentyl-4-methoxy-1-[2-(5-methylpyrazol-1-yl)ethyl]piperidine-4-carboxamide
CID 154565630
2-(2-methoxyphenyl)-4-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methyl]-5-methyl-1,3-oxazole
CID 53053460
methyl (2S)-1-[[2-(2-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]pyrrolidine-2-carboxylate
CID 42526423
2-(2-chlorophenyl)-4-[[4-(2-methoxyphenoxy)piperidin-1-yl]methyl]-5-methyl-1,3-oxazole
CID 42245325
4-[[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-2-(2-methoxyphenyl)-5-methyl-1,3-oxazole
CID 53053476
1-(3,5-dimethylmorpholin-4-yl)-2-[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]ethanone
CID 110631177
1-[[2-(2,5-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide
CID 56871770
4-[[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]methyl]-2-(2-methoxyphenyl)-5-methyl-1,3-oxazole
CID 53053463

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-methoxy-1-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide?
The IUPAC name of N-cyclopentyl-4-methoxy-1-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide (CID 154571106) is N-cyclopentyl-4-methoxy-1-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-methoxy-1-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide?
The canonical SMILES for N-cyclopentyl-4-methoxy-1-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide is COc1ccccc1-c1nc(CN2CCC(OC)(C(=O)NC3CCCC3)CC2)c(C)o1.
What is the InChIKey of N-cyclopentyl-4-methoxy-1-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide?
The InChIKey is BDSVGXGIZZBWTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N3O4/c1-17-20(26-22(31-17)19-10-6-7-11-21(19)29-2)16-27-14-12-24(30-3,13-15-27)23(28)25-18-8-4-5-9-18/h6-7,10-11,18H,4-5,8-9,12-16H2,1-3H3,(H,25,28).
What are the key properties of N-cyclopentyl-4-methoxy-1-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide?
N-cyclopentyl-4-methoxy-1-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide has a molecular weight of 427.55 g/mol, XLogP of 3.70, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-methoxy-1-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxamide is sourced from PubChem (CID 154571106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).