N-[(1R)-1-(furan-2-yl)ethyl]-2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)acetamide

C18H18N4O3 — CID 136872611

IUPACN-[(1R)-1-(furan-2-yl)ethyl]-2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)acetamide
SMILESCc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N[C@H](C)c1ccco1
InChIInChI=1S/C18H18N4O3/c1-11-13(10-16(23)20-12(2)15-7-5-9-25-15)18(24)22-17(21-11)14-6-3-4-8-19-14/h3-9,12H,10H2,1-2H3,(H,20,23)(H,21,22,24)/t12-/m1/s1
InChIKeyJMAVKSXCIMCVNX-GFCCVEGCSA-N
MW338.37 g/mol
LogP2.15
Rot. Bonds5

About N-[(1R)-1-(furan-2-yl)ethyl]-2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)acetamide

N-[(1R)-1-(furan-2-yl)ethyl]-2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)acetamide (PubChem CID 136872611) has the molecular formula C18H18N4O3 and a molecular weight of 338.37 g/mol. Its IUPAC name is N-[(1R)-1-(furan-2-yl)ethyl]-2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)acetamide.

Molecular Properties

Compound NameN-[(1R)-1-(furan-2-yl)ethyl]-2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)acetamide
PubChem CID136872611
Molecular FormulaC18H18N4O3
Molecular Weight338.37 g/mol
Exact Mass338.14
IUPAC NameN-[(1R)-1-(furan-2-yl)ethyl]-2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)acetamide
SMILESCc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N[C@H](C)c1ccco1
InChIInChI=1S/C18H18N4O3/c1-11-13(10-16(23)20-12(2)15-7-5-9-25-15)18(24)22-17(21-11)14-6-3-4-8-19-14/h3-9,12H,10H2,1-2H3,(H,20,23)(H,21,22,24)/t12-/m1/s1
InChIKeyJMAVKSXCIMCVNX-GFCCVEGCSA-N
XLogP2.15
TPSA100.88 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.37
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[(1R)-1-(furan-2-yl)ethyl]-2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)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

2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)-N-[(1R)-1-pyridin-4-ylethyl]acetamide
CID 136872605
2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)-N-(1-thiophen-2-ylethyl)acetamide
CID 135960467
2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)-N-[(2R)-pentan-2-yl]acetamide
CID 136902573
N-[1-(2,4-difluorophenyl)ethyl]-2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)acetamide
CID 135960543
2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)-N-[[(2S)-oxolan-2-yl]methyl]acetamide
CID 136727792
[(1R)-2-oxocyclohexyl] 2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)acetate
CID 136697436
N-[(1S)-2,3-dihydro-1H-inden-1-yl]-N-methyl-2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)acetamide
CID 135977009
4-hydroxy-5-propan-2-yl-2-pyridin-2-yl-1H-pyrimidin-6-one
CID 63612290
N-[(1S)-1-(furan-2-yl)ethyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 103940583
N-[1-(furan-2-yl)ethyl]-2-(4-methyl-2-sulfanylidene-3H-1,3-thiazol-5-yl)acetamide
CID 47128642
N-[(1S)-1-(furan-2-yl)ethyl]-3-(1,3,4-trimethyl-6-oxo-7H-pyrazolo[5,4-b]pyridin-5-yl)propanamide
CID 136898177
5-hydroxy-6-oxo-N-(1-phenylethyl)-2-pyridin-2-yl-1H-pyrimidine-4-carboxamide
CID 136593223

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(furan-2-yl)ethyl]-2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)acetamide?
The IUPAC name of N-[(1R)-1-(furan-2-yl)ethyl]-2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)acetamide (CID 136872611) is N-[(1R)-1-(furan-2-yl)ethyl]-2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)acetamide.
What is the SMILES notation for N-[(1R)-1-(furan-2-yl)ethyl]-2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)acetamide?
The canonical SMILES for N-[(1R)-1-(furan-2-yl)ethyl]-2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)acetamide is Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N[C@H](C)c1ccco1.
What is the InChIKey of N-[(1R)-1-(furan-2-yl)ethyl]-2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)acetamide?
The InChIKey is JMAVKSXCIMCVNX-GFCCVEGCSA-N. The full InChI is InChI=1S/C18H18N4O3/c1-11-13(10-16(23)20-12(2)15-7-5-9-25-15)18(24)22-17(21-11)14-6-3-4-8-19-14/h3-9,12H,10H2,1-2H3,(H,20,23)(H,21,22,24)/t12-/m1/s1.
What are the key properties of N-[(1R)-1-(furan-2-yl)ethyl]-2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)acetamide?
N-[(1R)-1-(furan-2-yl)ethyl]-2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)acetamide has a molecular weight of 338.37 g/mol, XLogP of 2.15, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(furan-2-yl)ethyl]-2-(4-methyl-6-oxo-2-pyridin-2-yl-1H-pyrimidin-5-yl)acetamide is sourced from PubChem (CID 136872611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).