5-(aminomethyl)-1-(1,2-oxazol-4-ylmethyl)piperidin-2-one

C10H15N3O2 — CID 82507791

IUPAC5-(aminomethyl)-1-(1,2-oxazol-4-ylmethyl)piperidin-2-one
SMILESNCC1CCC(=O)N(Cc2cnoc2)C1
InChIInChI=1S/C10H15N3O2/c11-3-8-1-2-10(14)13(5-8)6-9-4-12-15-7-9/h4,7-8H,1-3,5-6,11H2
InChIKeyRFCMGUVGXOXXOE-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.37
Rot. Bonds3

About 5-(aminomethyl)-1-(1,2-oxazol-4-ylmethyl)piperidin-2-one

5-(aminomethyl)-1-(1,2-oxazol-4-ylmethyl)piperidin-2-one (PubChem CID 82507791) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 5-(aminomethyl)-1-(1,2-oxazol-4-ylmethyl)piperidin-2-one.

Molecular Properties

Compound Name5-(aminomethyl)-1-(1,2-oxazol-4-ylmethyl)piperidin-2-one
PubChem CID82507791
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name5-(aminomethyl)-1-(1,2-oxazol-4-ylmethyl)piperidin-2-one
SMILESNCC1CCC(=O)N(Cc2cnoc2)C1
InChIInChI=1S/C10H15N3O2/c11-3-8-1-2-10(14)13(5-8)6-9-4-12-15-7-9/h4,7-8H,1-3,5-6,11H2
InChIKeyRFCMGUVGXOXXOE-UHFFFAOYSA-N
XLogP0.37
TPSA72.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-hydroxy-4-propyloxolan-2-one;1,2-oxazol-4-ylmethanamine;1-(1,2-oxazol-4-ylmethyl)-4-propylpyrrolidin-2-one;hydrochloride
CID 157083456
4-(aminomethyl)-1-[(6-chloro-3-pyridinyl)methyl]pyrrolidin-2-one
CID 168660327
(5S)-1-benzyl-5-prop-2-enylpiperidin-2-one
CID 157327222
4-[(4-methylpiperidin-1-yl)methyl]-1,2-oxazole
CID 130627037
1-benzyl-5-[(2-bromophenyl)methyl]piperidin-2-one
CID 24776493
1-(1,2-oxazol-4-ylmethyl)pyrrolidine-2-carboxylic acid
CID 60873081
4-(aminomethyl)-1-[(3,5-dimethoxyphenyl)methyl]pyrrolidin-2-one
CID 168659646
4-(aminomethyl)-1-[(4-pyrazol-1-ylphenyl)methyl]pyrrolidin-2-one
CID 168660316
4-[methyl(1,2-oxazol-4-ylmethyl)amino]cyclohexan-1-one
CID 79119691
4-amino-1-(pyrimidin-5-ylmethyl)pyrrolidin-2-one
CID 168700328
4-(aminomethyl)-1-benzylpyrrolidin-2-one;2,3-dihydroxybutanedioic acid
CID 14129465
4-(chloromethyl)-1-(pyrimidin-5-ylmethyl)pyrrolidin-2-one
CID 168508497

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-1-(1,2-oxazol-4-ylmethyl)piperidin-2-one?
The IUPAC name of 5-(aminomethyl)-1-(1,2-oxazol-4-ylmethyl)piperidin-2-one (CID 82507791) is 5-(aminomethyl)-1-(1,2-oxazol-4-ylmethyl)piperidin-2-one.
What is the SMILES notation for 5-(aminomethyl)-1-(1,2-oxazol-4-ylmethyl)piperidin-2-one?
The canonical SMILES for 5-(aminomethyl)-1-(1,2-oxazol-4-ylmethyl)piperidin-2-one is NCC1CCC(=O)N(Cc2cnoc2)C1.
What is the InChIKey of 5-(aminomethyl)-1-(1,2-oxazol-4-ylmethyl)piperidin-2-one?
The InChIKey is RFCMGUVGXOXXOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c11-3-8-1-2-10(14)13(5-8)6-9-4-12-15-7-9/h4,7-8H,1-3,5-6,11H2.
What are the key properties of 5-(aminomethyl)-1-(1,2-oxazol-4-ylmethyl)piperidin-2-one?
5-(aminomethyl)-1-(1,2-oxazol-4-ylmethyl)piperidin-2-one has a molecular weight of 209.25 g/mol, XLogP of 0.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-1-(1,2-oxazol-4-ylmethyl)piperidin-2-one is sourced from PubChem (CID 82507791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).