N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide

C18H27N5O2 — CID 124751686

IUPACN-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide
SMILESCCn1nc(C)c(NC(=O)CN2CCCC[C@@H]2c2cc(C)on2)c1C
InChIInChI=1S/C18H27N5O2/c1-5-23-14(4)18(13(3)20-23)19-17(24)11-22-9-7-6-8-16(22)15-10-12(2)25-21-15/h10,16H,5-9,11H2,1-4H3,(H,19,24)/t16-/m1/s1
InChIKeyHGZITUAYKDRIRT-MRXNPFEDSA-N
MW345.45 g/mol
LogP2.98
Rot. Bonds5

About N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide

N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide (PubChem CID 124751686) has the molecular formula C18H27N5O2 and a molecular weight of 345.45 g/mol. Its IUPAC name is N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide
PubChem CID124751686
Molecular FormulaC18H27N5O2
Molecular Weight345.45 g/mol
Exact Mass345.22
IUPAC NameN-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide
SMILESCCn1nc(C)c(NC(=O)CN2CCCC[C@@H]2c2cc(C)on2)c1C
InChIInChI=1S/C18H27N5O2/c1-5-23-14(4)18(13(3)20-23)19-17(24)11-22-9-7-6-8-16(22)15-10-12(2)25-21-15/h10,16H,5-9,11H2,1-4H3,(H,19,24)/t16-/m1/s1
InChIKeyHGZITUAYKDRIRT-MRXNPFEDSA-N
XLogP2.98
TPSA76.19 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.45
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(5-chloro-2-pyridinyl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide
CID 124754090
N-(3,4-difluorophenyl)-2-[(2S)-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]acetamide
CID 35244187
N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]acetamide
CID 91838166
N-(1-ethyl-3,5-dimethylpyrazol-4-yl)cyclopentanecarboxamide
CID 3564038
2-(4-acetyl-3,5-dimethylpyrazol-1-yl)-1-[2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]ethanone
CID 91796757
2-[2-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 91839248
2-[2-(hydroxymethyl)piperidin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 60684790
2-(2-methylpiperidin-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 51223569
N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(3S,4S)-3-hydroxy-4-(hydroxymethyl)piperidin-1-yl]acetamide
CID 133135484
N-(2-ethoxyphenyl)-3-[2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]propanamide
CID 91842043
N-(2,3-dihydro-1H-inden-5-yl)-3-[(2S)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]propanamide
CID 124758101
N-[(3S)-3-methyl-1,1-dioxothiolan-3-yl]-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-yl]acetamide
CID 30803881

Frequently Asked Questions

What is the IUPAC name of N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide?
The IUPAC name of N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide (CID 124751686) is N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide?
The canonical SMILES for N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide is CCn1nc(C)c(NC(=O)CN2CCCC[C@@H]2c2cc(C)on2)c1C.
What is the InChIKey of N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide?
The InChIKey is HGZITUAYKDRIRT-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H27N5O2/c1-5-23-14(4)18(13(3)20-23)19-17(24)11-22-9-7-6-8-16(22)15-10-12(2)25-21-15/h10,16H,5-9,11H2,1-4H3,(H,19,24)/t16-/m1/s1.
What are the key properties of N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide?
N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide has a molecular weight of 345.45 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)piperidin-1-yl]acetamide is sourced from PubChem (CID 124751686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).