N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-5-propyl-1H-pyrazole-3-carboxamide

C17H20N4O3 — CID 86821073

IUPACN-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-5-propyl-1H-pyrazole-3-carboxamide
SMILESCCCc1cc(C(=O)Nc2ccc(CN3CCOC3=O)cc2)n[nH]1
InChIInChI=1S/C17H20N4O3/c1-2-3-14-10-15(20-19-14)16(22)18-13-6-4-12(5-7-13)11-21-8-9-24-17(21)23/h4-7,10H,2-3,8-9,11H2,1H3,(H,18,22)(H,19,20)
InChIKeyCYPSHHZLEYLJJK-UHFFFAOYSA-N
MW328.37 g/mol
LogP2.57
Rot. Bonds6

About N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-5-propyl-1H-pyrazole-3-carboxamide

N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-5-propyl-1H-pyrazole-3-carboxamide (PubChem CID 86821073) has the molecular formula C17H20N4O3 and a molecular weight of 328.37 g/mol. Its IUPAC name is N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-5-propyl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound NameN-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-5-propyl-1H-pyrazole-3-carboxamide
PubChem CID86821073
Molecular FormulaC17H20N4O3
Molecular Weight328.37 g/mol
Exact Mass328.15
IUPAC NameN-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-5-propyl-1H-pyrazole-3-carboxamide
SMILESCCCc1cc(C(=O)Nc2ccc(CN3CCOC3=O)cc2)n[nH]1
InChIInChI=1S/C17H20N4O3/c1-2-3-14-10-15(20-19-14)16(22)18-13-6-4-12(5-7-13)11-21-8-9-24-17(21)23/h4-7,10H,2-3,8-9,11H2,1H3,(H,18,22)(H,19,20)
InChIKeyCYPSHHZLEYLJJK-UHFFFAOYSA-N
XLogP2.57
TPSA87.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-5-propyl-1H-pyrazole-3-carboxamide with MolForge

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Related Compounds

N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 70734717
1-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-3-(5-propan-2-yl-1H-pyrazol-3-yl)urea
CID 126791783
N-(3-acetamidophenyl)-5-propyl-1H-pyrazole-3-carboxamide
CID 36709127
N-(3,4-dimethylphenyl)-5-propyl-1H-pyrazole-3-carboxamide
CID 55555026
N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-1-phenyltriazole-4-carboxamide
CID 87028248
trans-(1R,2R)-2-[4-[(5-propyl-1H-pyrazole-3-carbonyl)amino]phenyl]cyclopropane-1-carboxylic acid
CID 138038240
N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-3-(2H-triazol-4-yl)propanamide
CID 126839263
N-[3-(morpholine-4-carbonyl)phenyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 46964376
N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-1-(2-phenylethyl)pyrrole-2-carboxamide
CID 86876348
5-hydroxy-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-2-propylpentanamide
CID 126839318
N-[2-(2-oxopiperidin-1-yl)ethyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 131936665
1-methyl-N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]indole-4-carboxamide
CID 71880143

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-5-propyl-1H-pyrazole-3-carboxamide?
The IUPAC name of N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-5-propyl-1H-pyrazole-3-carboxamide (CID 86821073) is N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-5-propyl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-5-propyl-1H-pyrazole-3-carboxamide?
The canonical SMILES for N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-5-propyl-1H-pyrazole-3-carboxamide is CCCc1cc(C(=O)Nc2ccc(CN3CCOC3=O)cc2)n[nH]1.
What is the InChIKey of N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-5-propyl-1H-pyrazole-3-carboxamide?
The InChIKey is CYPSHHZLEYLJJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O3/c1-2-3-14-10-15(20-19-14)16(22)18-13-6-4-12(5-7-13)11-21-8-9-24-17(21)23/h4-7,10H,2-3,8-9,11H2,1H3,(H,18,22)(H,19,20).
What are the key properties of N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-5-propyl-1H-pyrazole-3-carboxamide?
N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-5-propyl-1H-pyrazole-3-carboxamide has a molecular weight of 328.37 g/mol, XLogP of 2.57, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-oxo-1,3-oxazolidin-3-yl)methyl]phenyl]-5-propyl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 86821073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).