5-methyl-N-piperidin-4-yl-1,2-oxazole-4-carboxamide;hydrochloride

C10H16ClN3O2 — CID 47002718

IUPAC5-methyl-N-piperidin-4-yl-1,2-oxazole-4-carboxamide;hydrochloride
SMILESCc1oncc1C(=O)NC1CCNCC1.Cl
InChIInChI=1S/C10H15N3O2.ClH/c1-7-9(6-12-15-7)10(14)13-8-2-4-11-5-3-8;/h6,8,11H,2-5H2,1H3,(H,13,14);1H
InChIKeyUAELGCJYVHILGU-UHFFFAOYSA-N
MW245.71 g/mol
LogP0.89
Rot. Bonds2

About 5-methyl-N-piperidin-4-yl-1,2-oxazole-4-carboxamide;hydrochloride

5-methyl-N-piperidin-4-yl-1,2-oxazole-4-carboxamide;hydrochloride (PubChem CID 47002718) has the molecular formula C10H16ClN3O2 and a molecular weight of 245.71 g/mol. Its IUPAC name is 5-methyl-N-piperidin-4-yl-1,2-oxazole-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name5-methyl-N-piperidin-4-yl-1,2-oxazole-4-carboxamide;hydrochloride
PubChem CID47002718
Molecular FormulaC10H16ClN3O2
Molecular Weight245.71 g/mol
Exact Mass245.09
IUPAC Name5-methyl-N-piperidin-4-yl-1,2-oxazole-4-carboxamide;hydrochloride
SMILESCc1oncc1C(=O)NC1CCNCC1.Cl
InChIInChI=1S/C10H15N3O2.ClH/c1-7-9(6-12-15-7)10(14)13-8-2-4-11-5-3-8;/h6,8,11H,2-5H2,1H3,(H,13,14);1H
InChIKeyUAELGCJYVHILGU-UHFFFAOYSA-N
XLogP0.89
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.71
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclohexyl-5-methyl-1,2-oxazole-4-carboxamide
CID 3358009
Nerbacadol
CID 65865
N-isopropyl-5-methyl-4-isoxazolecarboxamide
CID 1477707
3,7-Diazabicyclo[3.3.1]nonan-3-yl-(5-methyl-1,2-oxazol-4-yl)methanone
CID 59268934
2-[(5-Methyl-1,2-oxazol-4-yl)formamido]propanoic acid
CID 16771058
1-(5-Methyl-1,2-oxazole-4-carbonyl)piperazine hydrochloride
CID 45791716
N-((1-(2-methoxyethyl)piperidin-4-yl)methyl)-5-methylisoxazole-4-carboxamide
CID 71806107
N-(2-cyclopropyl-2-hydroxypropyl)-5-methylisoxazole-4-carboxamide
CID 71806257
N-((1-(tert-butylcarbamoyl)piperidin-4-yl)methyl)-5-methylisoxazole-4-carboxamide
CID 71806280
N-((1-(cyclopropylsulfonyl)piperidin-4-yl)methyl)-5-methylisoxazole-4-carboxamide
CID 71806318
N-(5-Trifluoromethyl-4-isoxazolylcarbonyl)-piperidine
CID 13557180
N-(2-fluoroethyl)-5-methyl-1,2-oxazole-4-carboxamide
CID 53757803

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-piperidin-4-yl-1,2-oxazole-4-carboxamide;hydrochloride?
The IUPAC name of 5-methyl-N-piperidin-4-yl-1,2-oxazole-4-carboxamide;hydrochloride (CID 47002718) is 5-methyl-N-piperidin-4-yl-1,2-oxazole-4-carboxamide;hydrochloride.
What is the SMILES notation for 5-methyl-N-piperidin-4-yl-1,2-oxazole-4-carboxamide;hydrochloride?
The canonical SMILES for 5-methyl-N-piperidin-4-yl-1,2-oxazole-4-carboxamide;hydrochloride is Cc1oncc1C(=O)NC1CCNCC1.Cl.
What is the InChIKey of 5-methyl-N-piperidin-4-yl-1,2-oxazole-4-carboxamide;hydrochloride?
The InChIKey is UAELGCJYVHILGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2.ClH/c1-7-9(6-12-15-7)10(14)13-8-2-4-11-5-3-8;/h6,8,11H,2-5H2,1H3,(H,13,14);1H.
What are the key properties of 5-methyl-N-piperidin-4-yl-1,2-oxazole-4-carboxamide;hydrochloride?
5-methyl-N-piperidin-4-yl-1,2-oxazole-4-carboxamide;hydrochloride has a molecular weight of 245.71 g/mol, XLogP of 0.89, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-piperidin-4-yl-1,2-oxazole-4-carboxamide;hydrochloride is sourced from PubChem (CID 47002718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).