N-[5-[1-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide

C20H29N5O2 — CID 136521649

IUPACN-[5-[1-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide
SMILESCc1cnc(C(C)N2CCCC(c3[nH]ncc3NC(=O)C3CCCC3)C2)o1
InChIInChI=1S/C20H29N5O2/c1-13-10-21-20(27-13)14(2)25-9-5-8-16(12-25)18-17(11-22-24-18)23-19(26)15-6-3-4-7-15/h10-11,14-16H,3-9,12H2,1-2H3,(H,22,24)(H,23,26)
InChIKeyCWLUOQPLSRUTNV-UHFFFAOYSA-N
MW371.49 g/mol
LogP3.78
Rot. Bonds5

About N-[5-[1-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide

N-[5-[1-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide (PubChem CID 136521649) has the molecular formula C20H29N5O2 and a molecular weight of 371.49 g/mol. Its IUPAC name is N-[5-[1-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[5-[1-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide
PubChem CID136521649
Molecular FormulaC20H29N5O2
Molecular Weight371.49 g/mol
Exact Mass371.23
IUPAC NameN-[5-[1-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide
SMILESCc1cnc(C(C)N2CCCC(c3[nH]ncc3NC(=O)C3CCCC3)C2)o1
InChIInChI=1S/C20H29N5O2/c1-13-10-21-20(27-13)14(2)25-9-5-8-16(12-25)18-17(11-22-24-18)23-19(26)15-6-3-4-7-15/h10-11,14-16H,3-9,12H2,1-2H3,(H,22,24)(H,23,26)
InChIKeyCWLUOQPLSRUTNV-UHFFFAOYSA-N
XLogP3.78
TPSA87.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.49
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[5-[1-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide?
The IUPAC name of N-[5-[1-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide (CID 136521649) is N-[5-[1-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide.
What is the SMILES notation for N-[5-[1-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide?
The canonical SMILES for N-[5-[1-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide is Cc1cnc(C(C)N2CCCC(c3[nH]ncc3NC(=O)C3CCCC3)C2)o1.
What is the InChIKey of N-[5-[1-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide?
The InChIKey is CWLUOQPLSRUTNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N5O2/c1-13-10-21-20(27-13)14(2)25-9-5-8-16(12-25)18-17(11-22-24-18)23-19(26)15-6-3-4-7-15/h10-11,14-16H,3-9,12H2,1-2H3,(H,22,24)(H,23,26).
What are the key properties of N-[5-[1-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide?
N-[5-[1-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide has a molecular weight of 371.49 g/mol, XLogP of 3.78, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[1-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]piperidin-3-yl]-1H-pyrazol-4-yl]cyclopentanecarboxamide is sourced from PubChem (CID 136521649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).