5-(2-methylpropyl)-N-(1-pyrazin-2-ylpiperidin-3-yl)-1,2-oxazole-3-carboxamide

C17H23N5O2 — CID 91838367

IUPAC5-(2-methylpropyl)-N-(1-pyrazin-2-ylpiperidin-3-yl)-1,2-oxazole-3-carboxamide
SMILESCC(C)Cc1cc(C(=O)NC2CCCN(c3cnccn3)C2)no1
InChIInChI=1S/C17H23N5O2/c1-12(2)8-14-9-15(21-24-14)17(23)20-13-4-3-7-22(11-13)16-10-18-5-6-19-16/h5-6,9-10,12-13H,3-4,7-8,11H2,1-2H3,(H,20,23)
InChIKeyCRRZINTXHOHATE-UHFFFAOYSA-N
MW329.40 g/mol
LogP2.06
Rot. Bonds5

About 5-(2-methylpropyl)-N-(1-pyrazin-2-ylpiperidin-3-yl)-1,2-oxazole-3-carboxamide

5-(2-methylpropyl)-N-(1-pyrazin-2-ylpiperidin-3-yl)-1,2-oxazole-3-carboxamide (PubChem CID 91838367) has the molecular formula C17H23N5O2 and a molecular weight of 329.40 g/mol. Its IUPAC name is 5-(2-methylpropyl)-N-(1-pyrazin-2-ylpiperidin-3-yl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-(2-methylpropyl)-N-(1-pyrazin-2-ylpiperidin-3-yl)-1,2-oxazole-3-carboxamide
PubChem CID91838367
Molecular FormulaC17H23N5O2
Molecular Weight329.40 g/mol
Exact Mass329.19
IUPAC Name5-(2-methylpropyl)-N-(1-pyrazin-2-ylpiperidin-3-yl)-1,2-oxazole-3-carboxamide
SMILESCC(C)Cc1cc(C(=O)NC2CCCN(c3cnccn3)C2)no1
InChIInChI=1S/C17H23N5O2/c1-12(2)8-14-9-15(21-24-14)17(23)20-13-4-3-7-22(11-13)16-10-18-5-6-19-16/h5-6,9-10,12-13H,3-4,7-8,11H2,1-2H3,(H,20,23)
InChIKeyCRRZINTXHOHATE-UHFFFAOYSA-N
XLogP2.06
TPSA84.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[1-(furan-2-carbonyl)piperidin-3-yl]-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide
CID 91829889
2-(methylamino)-N-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]-1,3-thiazole-4-carboxamide
CID 99930841
N-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]-4-pyrrolidin-1-ylbenzamide
CID 99990589
3-methoxy-5-[[(3S)-1-pyrazin-2-ylpiperidin-3-yl]carbamoyl]benzoic acid
CID 126430008
1-(4-aminocyclohexyl)-N-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]triazole-4-carboxamide
CID 98273747
(3S)-N-methyl-1-pyrazin-2-ylpiperidin-3-amine
CID 94476433
1,6-dimethyl-N-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]indole-2-carboxamide
CID 126429000
N-(1-methylpiperidin-3-yl)pyrazine-2-carboxamide
CID 110471343
N-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]-2-pyrimidin-2-ylsulfanylacetamide
CID 99971826
N-propan-2-yl-1-pyrazin-2-ylpiperidine-3-carboxamide
CID 42950778
4-[(5-methyltetrazol-1-yl)methyl]-N-(1-pyrazin-2-ylpiperidin-3-yl)benzamide
CID 119062377
3-(2-aminoethoxy)-N-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]benzamide
CID 126433211

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylpropyl)-N-(1-pyrazin-2-ylpiperidin-3-yl)-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-(2-methylpropyl)-N-(1-pyrazin-2-ylpiperidin-3-yl)-1,2-oxazole-3-carboxamide (CID 91838367) is 5-(2-methylpropyl)-N-(1-pyrazin-2-ylpiperidin-3-yl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-(2-methylpropyl)-N-(1-pyrazin-2-ylpiperidin-3-yl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-(2-methylpropyl)-N-(1-pyrazin-2-ylpiperidin-3-yl)-1,2-oxazole-3-carboxamide is CC(C)Cc1cc(C(=O)NC2CCCN(c3cnccn3)C2)no1.
What is the InChIKey of 5-(2-methylpropyl)-N-(1-pyrazin-2-ylpiperidin-3-yl)-1,2-oxazole-3-carboxamide?
The InChIKey is CRRZINTXHOHATE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5O2/c1-12(2)8-14-9-15(21-24-14)17(23)20-13-4-3-7-22(11-13)16-10-18-5-6-19-16/h5-6,9-10,12-13H,3-4,7-8,11H2,1-2H3,(H,20,23).
What are the key properties of 5-(2-methylpropyl)-N-(1-pyrazin-2-ylpiperidin-3-yl)-1,2-oxazole-3-carboxamide?
5-(2-methylpropyl)-N-(1-pyrazin-2-ylpiperidin-3-yl)-1,2-oxazole-3-carboxamide has a molecular weight of 329.40 g/mol, XLogP of 2.06, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylpropyl)-N-(1-pyrazin-2-ylpiperidin-3-yl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 91838367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).