N-[(4-methoxyphenyl)-pyridin-2-ylmethyl]-N-methyl-1-(1,2-oxazole-5-carbonyl)piperidine-4-carboxamide

C24H26N4O4 — CID 126474628

IUPACN-[(4-methoxyphenyl)-pyridin-2-ylmethyl]-N-methyl-1-(1,2-oxazole-5-carbonyl)piperidine-4-carboxamide
SMILESCOc1ccc(C(c2ccccn2)N(C)C(=O)C2CCN(C(=O)c3ccno3)CC2)cc1
InChIInChI=1S/C24H26N4O4/c1-27(22(20-5-3-4-13-25-20)17-6-8-19(31-2)9-7-17)23(29)18-11-15-28(16-12-18)24(30)21-10-14-26-32-21/h3-10,13-14,18,22H,11-12,15-16H2,1-2H3
InChIKeyAANRCRSWHKSSOM-UHFFFAOYSA-N
MW434.50 g/mol
LogP3.18
Rot. Bonds6

About N-[(4-methoxyphenyl)-pyridin-2-ylmethyl]-N-methyl-1-(1,2-oxazole-5-carbonyl)piperidine-4-carboxamide

N-[(4-methoxyphenyl)-pyridin-2-ylmethyl]-N-methyl-1-(1,2-oxazole-5-carbonyl)piperidine-4-carboxamide (PubChem CID 126474628) has the molecular formula C24H26N4O4 and a molecular weight of 434.50 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)-pyridin-2-ylmethyl]-N-methyl-1-(1,2-oxazole-5-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)-pyridin-2-ylmethyl]-N-methyl-1-(1,2-oxazole-5-carbonyl)piperidine-4-carboxamide
PubChem CID126474628
Molecular FormulaC24H26N4O4
Molecular Weight434.50 g/mol
Exact Mass434.20
IUPAC NameN-[(4-methoxyphenyl)-pyridin-2-ylmethyl]-N-methyl-1-(1,2-oxazole-5-carbonyl)piperidine-4-carboxamide
SMILESCOc1ccc(C(c2ccccn2)N(C)C(=O)C2CCN(C(=O)c3ccno3)CC2)cc1
InChIInChI=1S/C24H26N4O4/c1-27(22(20-5-3-4-13-25-20)17-6-8-19(31-2)9-7-17)23(29)18-11-15-28(16-12-18)24(30)21-10-14-26-32-21/h3-10,13-14,18,22H,11-12,15-16H2,1-2H3
InChIKeyAANRCRSWHKSSOM-UHFFFAOYSA-N
XLogP3.18
TPSA88.77 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.50
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-[(4-methoxyphenyl)-pyridin-2-ylmethyl]-N-methyl-1-(1,2-oxazole-5-carbonyl)piperidine-4-carboxamide with MolForge

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Related Compounds

N-[(4-fluorophenyl)-pyridin-2-ylmethyl]-1-(furan-2-carbonyl)-N-methylpiperidine-4-carboxamide
CID 126471519
1-(2,2-dimethylpropanoyl)-N-[(4-fluorophenyl)-pyridin-2-ylmethyl]-N-methylpiperidine-4-carboxamide
CID 126473148
[4-(4-methoxyphenyl)piperazin-1-yl]-(1,2-oxazol-5-yl)methanone
CID 110693625
1-(1,2-oxazole-5-carbonyl)-N-[phenyl(pyrazin-2-yl)methyl]piperidine-4-carboxamide
CID 126475104
N-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methylcyclopentanecarboxamide
CID 95307336
1-acetyl-N-methyl-N-[(3-methyl-2-pyridinyl)-phenylmethyl]piperidine-4-carboxamide
CID 126471945
1-benzoyl-N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide
CID 110307099
1-[2-(4-methoxyphenyl)acetyl]-N-[phenyl(pyridin-2-yl)methyl]piperidine-4-carboxamide
CID 126473165
2-methoxyethyl 4-[[(4-methoxyphenyl)-pyridin-2-ylmethyl]carbamoyl]piperidine-1-carboxylate
CID 126475457
1-acetyl-N-[(4-fluorophenyl)-(3-methyl-2-pyridinyl)methyl]-N-methylpiperidine-4-carboxamide
CID 126473035
1-(4-methoxyphenyl)-1-pyridin-2-ylpropan-2-one
CID 174924212
1-(cyclopropanecarbonyl)-N-methyl-N-[(3-methyl-2-pyridinyl)-phenylmethyl]piperidine-4-carboxamide
CID 126474402

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)-pyridin-2-ylmethyl]-N-methyl-1-(1,2-oxazole-5-carbonyl)piperidine-4-carboxamide?
The IUPAC name of N-[(4-methoxyphenyl)-pyridin-2-ylmethyl]-N-methyl-1-(1,2-oxazole-5-carbonyl)piperidine-4-carboxamide (CID 126474628) is N-[(4-methoxyphenyl)-pyridin-2-ylmethyl]-N-methyl-1-(1,2-oxazole-5-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for N-[(4-methoxyphenyl)-pyridin-2-ylmethyl]-N-methyl-1-(1,2-oxazole-5-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for N-[(4-methoxyphenyl)-pyridin-2-ylmethyl]-N-methyl-1-(1,2-oxazole-5-carbonyl)piperidine-4-carboxamide is COc1ccc(C(c2ccccn2)N(C)C(=O)C2CCN(C(=O)c3ccno3)CC2)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)-pyridin-2-ylmethyl]-N-methyl-1-(1,2-oxazole-5-carbonyl)piperidine-4-carboxamide?
The InChIKey is AANRCRSWHKSSOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O4/c1-27(22(20-5-3-4-13-25-20)17-6-8-19(31-2)9-7-17)23(29)18-11-15-28(16-12-18)24(30)21-10-14-26-32-21/h3-10,13-14,18,22H,11-12,15-16H2,1-2H3.
What are the key properties of N-[(4-methoxyphenyl)-pyridin-2-ylmethyl]-N-methyl-1-(1,2-oxazole-5-carbonyl)piperidine-4-carboxamide?
N-[(4-methoxyphenyl)-pyridin-2-ylmethyl]-N-methyl-1-(1,2-oxazole-5-carbonyl)piperidine-4-carboxamide has a molecular weight of 434.50 g/mol, XLogP of 3.18, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)-pyridin-2-ylmethyl]-N-methyl-1-(1,2-oxazole-5-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 126474628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).