N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-piperidin-3-ylacetamide

C12H18N4O2 — CID 62674927

IUPACN-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-piperidin-3-ylacetamide
SMILESO=C(CC1CCCNC1)Nc1nnc(C2CC2)o1
InChIInChI=1S/C12H18N4O2/c17-10(6-8-2-1-5-13-7-8)14-12-16-15-11(18-12)9-3-4-9/h8-9,13H,1-7H2,(H,14,16,17)
InChIKeyBLKMJFXWTCERKS-UHFFFAOYSA-N
MW250.30 g/mol
LogP1.28
Rot. Bonds4

About N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-piperidin-3-ylacetamide

N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-piperidin-3-ylacetamide (PubChem CID 62674927) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-piperidin-3-ylacetamide.

Molecular Properties

Compound NameN-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-piperidin-3-ylacetamide
PubChem CID62674927
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC NameN-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-piperidin-3-ylacetamide
SMILESO=C(CC1CCCNC1)Nc1nnc(C2CC2)o1
InChIInChI=1S/C12H18N4O2/c17-10(6-8-2-1-5-13-7-8)14-12-16-15-11(18-12)9-3-4-9/h8-9,13H,1-7H2,(H,14,16,17)
InChIKeyBLKMJFXWTCERKS-UHFFFAOYSA-N
XLogP1.28
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-piperidin-3-ylacetamide?
The IUPAC name of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-piperidin-3-ylacetamide (CID 62674927) is N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-piperidin-3-ylacetamide.
What is the SMILES notation for N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-piperidin-3-ylacetamide?
The canonical SMILES for N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-piperidin-3-ylacetamide is O=C(CC1CCCNC1)Nc1nnc(C2CC2)o1.
What is the InChIKey of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-piperidin-3-ylacetamide?
The InChIKey is BLKMJFXWTCERKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c17-10(6-8-2-1-5-13-7-8)14-12-16-15-11(18-12)9-3-4-9/h8-9,13H,1-7H2,(H,14,16,17).
What are the key properties of N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-piperidin-3-ylacetamide?
N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-piperidin-3-ylacetamide has a molecular weight of 250.30 g/mol, XLogP of 1.28, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-2-piperidin-3-ylacetamide is sourced from PubChem (CID 62674927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).