N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide

C18H22N4O2 — CID 31847985

IUPACN-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESCN(Cc1cnn(C)c1)C(=O)Cc1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C18H22N4O2/c1-20(12-15-11-19-21(2)13-15)18(24)10-14-5-7-16(8-6-14)22-9-3-4-17(22)23/h5-8,11,13H,3-4,9-10,12H2,1-2H3
InChIKeyJGZHBJAVHAEJSM-UHFFFAOYSA-N
MW326.40 g/mol
LogP1.75
Rot. Bonds5

About N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide

N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide (PubChem CID 31847985) has the molecular formula C18H22N4O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
PubChem CID31847985
Molecular FormulaC18H22N4O2
Molecular Weight326.40 g/mol
Exact Mass326.17
IUPAC NameN-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESCN(Cc1cnn(C)c1)C(=O)Cc1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C18H22N4O2/c1-20(12-15-11-19-21(2)13-15)18(24)10-14-5-7-16(8-6-14)22-9-3-4-17(22)23/h5-8,11,13H,3-4,9-10,12H2,1-2H3
InChIKeyJGZHBJAVHAEJSM-UHFFFAOYSA-N
XLogP1.75
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 27666071
(2S)-2-methyl-3-[methyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]propanoic acid
CID 124689242
N-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 9469985
N-methyl-N-[2-(4-methylphenoxy)ethyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 27447938
N-[(4-methoxyphenyl)methyl]-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenoxy]acetamide
CID 51240858
N-ethyl-N-(2-hydroxyethyl)-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 78821691
2-(2-methoxyphenyl)-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]acetamide
CID 134037061
N-[(4-ethoxyphenyl)methyl]-N-methyl-4-(2-oxopyrrolidin-1-yl)benzamide
CID 27822823
N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-ethyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 25496038
N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 9299632
N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-4-(2-oxopiperidin-1-yl)benzamide
CID 18116240
2-methyl-1-[3-(1-methylpyrazol-4-yl)propyl]-3-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]guanidine;hydroiodide
CID 111413603

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The IUPAC name of N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide (CID 31847985) is N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide.
What is the SMILES notation for N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The canonical SMILES for N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide is CN(Cc1cnn(C)c1)C(=O)Cc1ccc(N2CCCC2=O)cc1.
What is the InChIKey of N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The InChIKey is JGZHBJAVHAEJSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O2/c1-20(12-15-11-19-21(2)13-15)18(24)10-14-5-7-16(8-6-14)22-9-3-4-17(22)23/h5-8,11,13H,3-4,9-10,12H2,1-2H3.
What are the key properties of N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide has a molecular weight of 326.40 g/mol, XLogP of 1.75, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide is sourced from PubChem (CID 31847985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).