3-ethyl-N,5-dimethyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide

C18H24N4O2 — CID 125005100

IUPAC3-ethyl-N,5-dimethyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide
SMILESCCc1noc(C)c1C(=O)N(C)[C@H]1CCCN(c2ccccn2)C1
InChIInChI=1S/C18H24N4O2/c1-4-15-17(13(2)24-20-15)18(23)21(3)14-8-7-11-22(12-14)16-9-5-6-10-19-16/h5-6,9-10,14H,4,7-8,11-12H2,1-3H3/t14-/m0/s1
InChIKeyTWWUIKVDUFHBDJ-AWEZNQCLSA-N
MW328.42 g/mol
LogP2.68
Rot. Bonds4

About 3-ethyl-N,5-dimethyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide

3-ethyl-N,5-dimethyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide (PubChem CID 125005100) has the molecular formula C18H24N4O2 and a molecular weight of 328.42 g/mol. Its IUPAC name is 3-ethyl-N,5-dimethyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name3-ethyl-N,5-dimethyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide
PubChem CID125005100
Molecular FormulaC18H24N4O2
Molecular Weight328.42 g/mol
Exact Mass328.19
IUPAC Name3-ethyl-N,5-dimethyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide
SMILESCCc1noc(C)c1C(=O)N(C)[C@H]1CCCN(c2ccccn2)C1
InChIInChI=1S/C18H24N4O2/c1-4-15-17(13(2)24-20-15)18(23)21(3)14-8-7-11-22(12-14)16-9-5-6-10-19-16/h5-6,9-10,14H,4,7-8,11-12H2,1-3H3/t14-/m0/s1
InChIKeyTWWUIKVDUFHBDJ-AWEZNQCLSA-N
XLogP2.68
TPSA62.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3-ethyl-N,5-dimethyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide with MolForge

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Related Compounds

N,6-dimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-2-carboxamide
CID 124981919
N,3,5-trimethyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]-1,2-oxazole-4-carboxamide
CID 125003122
3-ethyl-N-[[(3R)-3-hydroxy-1-pyridin-2-ylpiperidin-3-yl]methyl]-N,5-dimethyl-1,2-oxazole-4-carboxamide
CID 124959595
N-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]cyclopentanecarboxamide
CID 124952652
N,1,3-trimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyrazole-4-carboxamide
CID 124986213
N,1,3-trimethyl-N-(1-pyridin-2-ylpiperidin-3-yl)pyrazole-4-carboxamide
CID 110107211
tert-butyl N-methyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]carbamate
CID 97166902
N-methyl-2-(5-methylthiophen-2-yl)-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]acetamide
CID 124975661
N-methyl-3-(2-methylpyrazol-3-yl)-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]propanamide
CID 124997513
N-methyl-N-(1-pyridin-2-ylpiperidin-3-yl)ethanesulfonamide
CID 110107181
N,6-dimethyl-2-oxo-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]-1H-pyrimidine-4-carboxamide
CID 124974314
N-methyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1H-indole-2-carboxamide
CID 125008427

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N,5-dimethyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide?
The IUPAC name of 3-ethyl-N,5-dimethyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide (CID 125005100) is 3-ethyl-N,5-dimethyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide.
What is the SMILES notation for 3-ethyl-N,5-dimethyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide?
The canonical SMILES for 3-ethyl-N,5-dimethyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide is CCc1noc(C)c1C(=O)N(C)[C@H]1CCCN(c2ccccn2)C1.
What is the InChIKey of 3-ethyl-N,5-dimethyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide?
The InChIKey is TWWUIKVDUFHBDJ-AWEZNQCLSA-N. The full InChI is InChI=1S/C18H24N4O2/c1-4-15-17(13(2)24-20-15)18(23)21(3)14-8-7-11-22(12-14)16-9-5-6-10-19-16/h5-6,9-10,14H,4,7-8,11-12H2,1-3H3/t14-/m0/s1.
What are the key properties of 3-ethyl-N,5-dimethyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide?
3-ethyl-N,5-dimethyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide has a molecular weight of 328.42 g/mol, XLogP of 2.68, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N,5-dimethyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 125005100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).