3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3S)-1-methylpiperidin-3-yl]propanamide

C14H23N3O2 — CID 94194350

IUPAC3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3S)-1-methylpiperidin-3-yl]propanamide
SMILESCc1noc(C)c1CCC(=O)N[C@H]1CCCN(C)C1
InChIInChI=1S/C14H23N3O2/c1-10-13(11(2)19-16-10)6-7-14(18)15-12-5-4-8-17(3)9-12/h12H,4-9H2,1-3H3,(H,15,18)/t12-/m0/s1
InChIKeyKFQPZHYMPBCHGP-LBPRGKRZSA-N
MW265.36 g/mol
LogP1.43
Rot. Bonds4

About 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3S)-1-methylpiperidin-3-yl]propanamide

3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3S)-1-methylpiperidin-3-yl]propanamide (PubChem CID 94194350) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3S)-1-methylpiperidin-3-yl]propanamide.

Molecular Properties

Compound Name3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3S)-1-methylpiperidin-3-yl]propanamide
PubChem CID94194350
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3S)-1-methylpiperidin-3-yl]propanamide
SMILESCc1noc(C)c1CCC(=O)N[C@H]1CCCN(C)C1
InChIInChI=1S/C14H23N3O2/c1-10-13(11(2)19-16-10)6-7-14(18)15-12-5-4-8-17(3)9-12/h12H,4-9H2,1-3H3,(H,15,18)/t12-/m0/s1
InChIKeyKFQPZHYMPBCHGP-LBPRGKRZSA-N
XLogP1.43
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3S)-1-methylpiperidin-3-yl]propanamide?
The IUPAC name of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3S)-1-methylpiperidin-3-yl]propanamide (CID 94194350) is 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3S)-1-methylpiperidin-3-yl]propanamide.
What is the SMILES notation for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3S)-1-methylpiperidin-3-yl]propanamide?
The canonical SMILES for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3S)-1-methylpiperidin-3-yl]propanamide is Cc1noc(C)c1CCC(=O)N[C@H]1CCCN(C)C1.
What is the InChIKey of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3S)-1-methylpiperidin-3-yl]propanamide?
The InChIKey is KFQPZHYMPBCHGP-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-10-13(11(2)19-16-10)6-7-14(18)15-12-5-4-8-17(3)9-12/h12H,4-9H2,1-3H3,(H,15,18)/t12-/m0/s1.
What are the key properties of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3S)-1-methylpiperidin-3-yl]propanamide?
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3S)-1-methylpiperidin-3-yl]propanamide has a molecular weight of 265.36 g/mol, XLogP of 1.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3S)-1-methylpiperidin-3-yl]propanamide is sourced from PubChem (CID 94194350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).