2-(1-ethylpiperidin-4-yl)-N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]acetamide

C15H25N3O2 — CID 97144520

IUPAC2-(1-ethylpiperidin-4-yl)-N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]acetamide
SMILESCCN1CCC(CC(=O)N(C)[C@@H](C)c2ccon2)CC1
InChIInChI=1S/C15H25N3O2/c1-4-18-8-5-13(6-9-18)11-15(19)17(3)12(2)14-7-10-20-16-14/h7,10,12-13H,4-6,8-9,11H2,1-3H3/t12-/m0/s1
InChIKeyVPUCMHLRNPSPGV-LBPRGKRZSA-N
MW279.38 g/mol
LogP2.32
Rot. Bonds5

About 2-(1-ethylpiperidin-4-yl)-N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]acetamide

2-(1-ethylpiperidin-4-yl)-N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]acetamide (PubChem CID 97144520) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is 2-(1-ethylpiperidin-4-yl)-N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(1-ethylpiperidin-4-yl)-N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]acetamide
PubChem CID97144520
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name2-(1-ethylpiperidin-4-yl)-N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]acetamide
SMILESCCN1CCC(CC(=O)N(C)[C@@H](C)c2ccon2)CC1
InChIInChI=1S/C15H25N3O2/c1-4-18-8-5-13(6-9-18)11-15(19)17(3)12(2)14-7-10-20-16-14/h7,10,12-13H,4-6,8-9,11H2,1-3H3/t12-/m0/s1
InChIKeyVPUCMHLRNPSPGV-LBPRGKRZSA-N
XLogP2.32
TPSA49.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylpiperidin-4-yl)-N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]acetamide?
The IUPAC name of 2-(1-ethylpiperidin-4-yl)-N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]acetamide (CID 97144520) is 2-(1-ethylpiperidin-4-yl)-N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]acetamide.
What is the SMILES notation for 2-(1-ethylpiperidin-4-yl)-N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]acetamide?
The canonical SMILES for 2-(1-ethylpiperidin-4-yl)-N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]acetamide is CCN1CCC(CC(=O)N(C)[C@@H](C)c2ccon2)CC1.
What is the InChIKey of 2-(1-ethylpiperidin-4-yl)-N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]acetamide?
The InChIKey is VPUCMHLRNPSPGV-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-4-18-8-5-13(6-9-18)11-15(19)17(3)12(2)14-7-10-20-16-14/h7,10,12-13H,4-6,8-9,11H2,1-3H3/t12-/m0/s1.
What are the key properties of 2-(1-ethylpiperidin-4-yl)-N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]acetamide?
2-(1-ethylpiperidin-4-yl)-N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]acetamide has a molecular weight of 279.38 g/mol, XLogP of 2.32, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylpiperidin-4-yl)-N-methyl-N-[(1S)-1-(1,2-oxazol-3-yl)ethyl]acetamide is sourced from PubChem (CID 97144520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).