2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide

C20H26N4O2 — CID 135960488

IUPAC2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide
SMILESCc1nc(C)c(CC(=O)N(C)Cc2ccccc2N2CCCC2)c(=O)[nH]1
InChIInChI=1S/C20H26N4O2/c1-14-17(20(26)22-15(2)21-14)12-19(25)23(3)13-16-8-4-5-9-18(16)24-10-6-7-11-24/h4-5,8-9H,6-7,10-13H2,1-3H3,(H,21,22,26)
InChIKeyPSDWRXNHKAOKTQ-UHFFFAOYSA-N
MW354.45 g/mol
LogP2.19
Rot. Bonds5

About 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide

2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide (PubChem CID 135960488) has the molecular formula C20H26N4O2 and a molecular weight of 354.45 g/mol. Its IUPAC name is 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide
PubChem CID135960488
Molecular FormulaC20H26N4O2
Molecular Weight354.45 g/mol
Exact Mass354.21
IUPAC Name2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide
SMILESCc1nc(C)c(CC(=O)N(C)Cc2ccccc2N2CCCC2)c(=O)[nH]1
InChIInChI=1S/C20H26N4O2/c1-14-17(20(26)22-15(2)21-14)12-19(25)23(3)13-16-8-4-5-9-18(16)24-10-6-7-11-24/h4-5,8-9H,6-7,10-13H2,1-3H3,(H,21,22,26)
InChIKeyPSDWRXNHKAOKTQ-UHFFFAOYSA-N
XLogP2.19
TPSA69.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide 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

N-methyl-3-(4-oxo-3H-quinazolin-2-yl)-N-[(2-pyrrolidin-1-ylphenyl)methyl]propanamide
CID 137287838
N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-methylacetamide
CID 137264861
4-[[[2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetyl]-methylamino]methyl]benzamide
CID 135891201
3-(1H-benzimidazol-2-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]propanamide
CID 43045408
3-(4,6-dimethyl-1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]propanamide
CID 17419738
N-methyl-3-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[(2-pyrrolidin-1-ylphenyl)methyl]propanamide
CID 55415811
3-(2,4-dioxoquinazolin-1-yl)-N-methyl-N-[(2-piperidin-1-ylphenyl)methyl]propanamide
CID 24551664
1-hydroxy-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]cyclopentane-1-carboxamide
CID 110907044
3-(2-bromophenyl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]propanamide
CID 52669946
N-cyclopropyl-N-(2,3-dihydro-1H-inden-2-yl)-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide
CID 136908392
N-methyl-2-[(4S)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-[(2-piperidin-1-ylphenyl)methyl]acetamide
CID 41023343
N,2,4,5-tetramethyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]thieno[2,3-d]pyrimidine-6-carboxamide
CID 52671490

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide?
The IUPAC name of 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide (CID 135960488) is 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide.
What is the SMILES notation for 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide?
The canonical SMILES for 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide is Cc1nc(C)c(CC(=O)N(C)Cc2ccccc2N2CCCC2)c(=O)[nH]1.
What is the InChIKey of 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide?
The InChIKey is PSDWRXNHKAOKTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O2/c1-14-17(20(26)22-15(2)21-14)12-19(25)23(3)13-16-8-4-5-9-18(16)24-10-6-7-11-24/h4-5,8-9H,6-7,10-13H2,1-3H3,(H,21,22,26).
What are the key properties of 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide?
2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide has a molecular weight of 354.45 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide is sourced from PubChem (CID 135960488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).