N-[[3-(2-methylpyrazol-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-pyrrol-1-ylbenzamide

C19H19N5O3 — CID 84579789

IUPACN-[[3-(2-methylpyrazol-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-pyrrol-1-ylbenzamide
SMILESCn1nccc1N1CC(CNC(=O)c2ccc(-n3cccc3)cc2)OC1=O
InChIInChI=1S/C19H19N5O3/c1-22-17(8-9-21-22)24-13-16(27-19(24)26)12-20-18(25)14-4-6-15(7-5-14)23-10-2-3-11-23/h2-11,16H,12-13H2,1H3,(H,20,25)
InChIKeyKAILPAQERVERBO-UHFFFAOYSA-N
MW365.39 g/mol
LogP1.97
Rot. Bonds5

About N-[[3-(2-methylpyrazol-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-pyrrol-1-ylbenzamide

N-[[3-(2-methylpyrazol-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-pyrrol-1-ylbenzamide (PubChem CID 84579789) has the molecular formula C19H19N5O3 and a molecular weight of 365.39 g/mol. Its IUPAC name is N-[[3-(2-methylpyrazol-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-pyrrol-1-ylbenzamide.

Molecular Properties

Compound NameN-[[3-(2-methylpyrazol-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-pyrrol-1-ylbenzamide
PubChem CID84579789
Molecular FormulaC19H19N5O3
Molecular Weight365.39 g/mol
Exact Mass365.15
IUPAC NameN-[[3-(2-methylpyrazol-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-pyrrol-1-ylbenzamide
SMILESCn1nccc1N1CC(CNC(=O)c2ccc(-n3cccc3)cc2)OC1=O
InChIInChI=1S/C19H19N5O3/c1-22-17(8-9-21-22)24-13-16(27-19(24)26)12-20-18(25)14-4-6-15(7-5-14)23-10-2-3-11-23/h2-11,16H,12-13H2,1H3,(H,20,25)
InChIKeyKAILPAQERVERBO-UHFFFAOYSA-N
XLogP1.97
TPSA81.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[3-(2-methylpyrazol-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-phenylbenzamide
CID 84579634
N-[[3-(2-methylpyrazol-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-(trifluoromethyl)benzamide
CID 84582118
3,4-dichloro-N-[[3-(2-methylpyrazol-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]benzamide
CID 84580703
3-(4-ethylphenyl)-N-[[3-(2-methylpyrazol-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]propanamide
CID 112532685
4-fluoro-N-[[3-(4-fluorophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]benzamide
CID 16920743
N-[[(2R)-oxolan-2-yl]methyl]-4-pyrrol-1-ylbenzamide
CID 25343764
N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]pyridine-4-carboxamide
CID 110710356
N-[[3-(4-methylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-(trifluoromethyl)benzamide
CID 16920617
N-[[3-(3-chlorophenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-methylbenzamide
CID 16921024
N-[[3-(3,4-dimethylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-methoxybenzamide
CID 110328021
N-[[(3S,8aS)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-3-yl]methyl]-4-pyrrol-1-ylbenzamide
CID 98750642
3,4-dimethyl-N-[[3-(3-methylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]benzamide
CID 110327775

Frequently Asked Questions

What is the IUPAC name of N-[[3-(2-methylpyrazol-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-pyrrol-1-ylbenzamide?
The IUPAC name of N-[[3-(2-methylpyrazol-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-pyrrol-1-ylbenzamide (CID 84579789) is N-[[3-(2-methylpyrazol-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-pyrrol-1-ylbenzamide.
What is the SMILES notation for N-[[3-(2-methylpyrazol-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-pyrrol-1-ylbenzamide?
The canonical SMILES for N-[[3-(2-methylpyrazol-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-pyrrol-1-ylbenzamide is Cn1nccc1N1CC(CNC(=O)c2ccc(-n3cccc3)cc2)OC1=O.
What is the InChIKey of N-[[3-(2-methylpyrazol-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-pyrrol-1-ylbenzamide?
The InChIKey is KAILPAQERVERBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O3/c1-22-17(8-9-21-22)24-13-16(27-19(24)26)12-20-18(25)14-4-6-15(7-5-14)23-10-2-3-11-23/h2-11,16H,12-13H2,1H3,(H,20,25).
What are the key properties of N-[[3-(2-methylpyrazol-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-pyrrol-1-ylbenzamide?
N-[[3-(2-methylpyrazol-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-pyrrol-1-ylbenzamide has a molecular weight of 365.39 g/mol, XLogP of 1.97, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(2-methylpyrazol-3-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]-4-pyrrol-1-ylbenzamide is sourced from PubChem (CID 84579789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).