1-(4-hydroxyphenyl)-N-[(5-methylpyrazin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide

C17H18N4O3 — CID 74240649

IUPAC1-(4-hydroxyphenyl)-N-[(5-methylpyrazin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide
SMILESCc1cnc(CNC(=O)C2CC(=O)N(c3ccc(O)cc3)C2)cn1
InChIInChI=1S/C17H18N4O3/c1-11-7-19-13(8-18-11)9-20-17(24)12-6-16(23)21(10-12)14-2-4-15(22)5-3-14/h2-5,7-8,12,22H,6,9-10H2,1H3,(H,20,24)
InChIKeyRLOPJFBVVNPEGA-UHFFFAOYSA-N
MW326.36 g/mol
LogP1.16
Rot. Bonds4

About 1-(4-hydroxyphenyl)-N-[(5-methylpyrazin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide

1-(4-hydroxyphenyl)-N-[(5-methylpyrazin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide (PubChem CID 74240649) has the molecular formula C17H18N4O3 and a molecular weight of 326.36 g/mol. Its IUPAC name is 1-(4-hydroxyphenyl)-N-[(5-methylpyrazin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-(4-hydroxyphenyl)-N-[(5-methylpyrazin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide
PubChem CID74240649
Molecular FormulaC17H18N4O3
Molecular Weight326.36 g/mol
Exact Mass326.14
IUPAC Name1-(4-hydroxyphenyl)-N-[(5-methylpyrazin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide
SMILESCc1cnc(CNC(=O)C2CC(=O)N(c3ccc(O)cc3)C2)cn1
InChIInChI=1S/C17H18N4O3/c1-11-7-19-13(8-18-11)9-20-17(24)12-6-16(23)21(10-12)14-2-4-15(22)5-3-14/h2-5,7-8,12,22H,6,9-10H2,1H3,(H,20,24)
InChIKeyRLOPJFBVVNPEGA-UHFFFAOYSA-N
XLogP1.16
TPSA95.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.36
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-(4-hydroxyphenyl)-N-[(5-methylpyrazin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-hydroxyphenyl)-N-(2-methylpropyl)-5-oxopyrrolidine-3-carboxamide
CID 2955573
(3R)-1-(4-hydroxyphenyl)-5-oxo-N-(thiophen-2-ylmethyl)pyrrolidine-3-carboxamide
CID 41468767
2-[[1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carbonyl]amino]acetic acid
CID 82043433
(3S)-1-(4-hydroxyphenyl)-N-[(4-methoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 7248206
1-(4-hydroxyphenyl)-N-(2-hydroxypropyl)-5-oxopyrrolidine-3-carboxamide
CID 3159237
1-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-N-[(5-methylpyrazin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 155495117
1-(4-hydroxyphenyl)-5-oxo-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]pyrrolidine-3-carboxamide
CID 131930496
1-(4-methylphenyl)-N-[(6-methyl-2-piperidin-1-ylpyrimidin-4-yl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 122352811
(3S)-5-oxo-1-(4-propan-2-ylphenyl)-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide
CID 93018322
(3R)-N-(5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-ylmethyl)-1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 98276888
(3R)-1-(4-fluorophenyl)-5-oxo-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide
CID 7228556
1-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]-N-[(5-methylpyrazin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide;formic acid
CID 155940666

Frequently Asked Questions

What is the IUPAC name of 1-(4-hydroxyphenyl)-N-[(5-methylpyrazin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of 1-(4-hydroxyphenyl)-N-[(5-methylpyrazin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide (CID 74240649) is 1-(4-hydroxyphenyl)-N-[(5-methylpyrazin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for 1-(4-hydroxyphenyl)-N-[(5-methylpyrazin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for 1-(4-hydroxyphenyl)-N-[(5-methylpyrazin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide is Cc1cnc(CNC(=O)C2CC(=O)N(c3ccc(O)cc3)C2)cn1.
What is the InChIKey of 1-(4-hydroxyphenyl)-N-[(5-methylpyrazin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide?
The InChIKey is RLOPJFBVVNPEGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O3/c1-11-7-19-13(8-18-11)9-20-17(24)12-6-16(23)21(10-12)14-2-4-15(22)5-3-14/h2-5,7-8,12,22H,6,9-10H2,1H3,(H,20,24).
What are the key properties of 1-(4-hydroxyphenyl)-N-[(5-methylpyrazin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide?
1-(4-hydroxyphenyl)-N-[(5-methylpyrazin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide has a molecular weight of 326.36 g/mol, XLogP of 1.16, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxyphenyl)-N-[(5-methylpyrazin-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 74240649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).