5-[1-[(5-ethyl-1,3-oxazol-2-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide

C15H21N5O2 — CID 71927110

IUPAC5-[1-[(5-ethyl-1,3-oxazol-2-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide
SMILESCCc1cnc(CN2CCCC(c3cc(C(N)=O)n[nH]3)C2)o1
InChIInChI=1S/C15H21N5O2/c1-2-11-7-17-14(22-11)9-20-5-3-4-10(8-20)12-6-13(15(16)21)19-18-12/h6-7,10H,2-5,8-9H2,1H3,(H2,16,21)(H,18,19)
InChIKeyAKDUKESVAVLOOW-UHFFFAOYSA-N
MW303.37 g/mol
LogP1.44
Rot. Bonds5

About 5-[1-[(5-ethyl-1,3-oxazol-2-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide

5-[1-[(5-ethyl-1,3-oxazol-2-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide (PubChem CID 71927110) has the molecular formula C15H21N5O2 and a molecular weight of 303.37 g/mol. Its IUPAC name is 5-[1-[(5-ethyl-1,3-oxazol-2-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-[1-[(5-ethyl-1,3-oxazol-2-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide
PubChem CID71927110
Molecular FormulaC15H21N5O2
Molecular Weight303.37 g/mol
Exact Mass303.17
IUPAC Name5-[1-[(5-ethyl-1,3-oxazol-2-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide
SMILESCCc1cnc(CN2CCCC(c3cc(C(N)=O)n[nH]3)C2)o1
InChIInChI=1S/C15H21N5O2/c1-2-11-7-17-14(22-11)9-20-5-3-4-10(8-20)12-6-13(15(16)21)19-18-12/h6-7,10H,2-5,8-9H2,1H3,(H2,16,21)(H,18,19)
InChIKeyAKDUKESVAVLOOW-UHFFFAOYSA-N
XLogP1.44
TPSA101.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[1-[(5-ethyl-1,3-oxazol-2-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-[1-[(5-ethyl-1,3-oxazol-2-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide (CID 71927110) is 5-[1-[(5-ethyl-1,3-oxazol-2-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-[1-[(5-ethyl-1,3-oxazol-2-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-[1-[(5-ethyl-1,3-oxazol-2-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide is CCc1cnc(CN2CCCC(c3cc(C(N)=O)n[nH]3)C2)o1.
What is the InChIKey of 5-[1-[(5-ethyl-1,3-oxazol-2-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide?
The InChIKey is AKDUKESVAVLOOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O2/c1-2-11-7-17-14(22-11)9-20-5-3-4-10(8-20)12-6-13(15(16)21)19-18-12/h6-7,10H,2-5,8-9H2,1H3,(H2,16,21)(H,18,19).
What are the key properties of 5-[1-[(5-ethyl-1,3-oxazol-2-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide?
5-[1-[(5-ethyl-1,3-oxazol-2-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide has a molecular weight of 303.37 g/mol, XLogP of 1.44, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-[(5-ethyl-1,3-oxazol-2-yl)methyl]piperidin-3-yl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 71927110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).