N-cyclopentyl-2-(4-methyl-2-oxopyrimidin-1-yl)acetamide

C12H17N3O2 — CID 113230936

IUPACN-cyclopentyl-2-(4-methyl-2-oxopyrimidin-1-yl)acetamide
SMILESCc1ccn(CC(=O)NC2CCCC2)c(=O)n1
InChIInChI=1S/C12H17N3O2/c1-9-6-7-15(12(17)13-9)8-11(16)14-10-4-2-3-5-10/h6-7,10H,2-5,8H2,1H3,(H,14,16)
InChIKeyVMVPAAHGPOTRAP-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.61
Rot. Bonds3

About N-cyclopentyl-2-(4-methyl-2-oxopyrimidin-1-yl)acetamide

N-cyclopentyl-2-(4-methyl-2-oxopyrimidin-1-yl)acetamide (PubChem CID 113230936) has the molecular formula C12H17N3O2 and a molecular weight of 235.29 g/mol. Its IUPAC name is N-cyclopentyl-2-(4-methyl-2-oxopyrimidin-1-yl)acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(4-methyl-2-oxopyrimidin-1-yl)acetamide
PubChem CID113230936
Molecular FormulaC12H17N3O2
Molecular Weight235.29 g/mol
Exact Mass235.13
IUPAC NameN-cyclopentyl-2-(4-methyl-2-oxopyrimidin-1-yl)acetamide
SMILESCc1ccn(CC(=O)NC2CCCC2)c(=O)n1
InChIInChI=1S/C12H17N3O2/c1-9-6-7-15(12(17)13-9)8-11(16)14-10-4-2-3-5-10/h6-7,10H,2-5,8H2,1H3,(H,14,16)
InChIKeyVMVPAAHGPOTRAP-UHFFFAOYSA-N
XLogP0.61
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-butyl(4-butylimino-6-methyl-2-oxo-1,2,3,4-tetrahydro-3-pyrimidinyl)-acetamide
CID 129791878
2-(4,6-dimethyl-2-oxopyrimidin-1-yl)-N-[(1S,2R)-2-fluorocyclopentyl]acetamide
CID 137981272
2-(ethylamino)-7-methyl-4-(2-oxopropyl)-2H-1,4-diazepin-3-one
CID 20711607
2-(ethylamino)-7-methyl-4-(2-oxopropyl)-2H-1,4-diazepin-3-one;methane
CID 158490253
2-[2-(ethylamino)-7-methyl-3-oxo-2H-1,4-diazepin-4-yl]acetamide
CID 20711612
N-cyclohexyl-2-(4-methyl-2-oxopyrimidin-1-yl)acetamide
CID 113230937
N-(3-methylbutan-2-yl)-2-(4-methyl-2-oxopyrimidin-1-yl)acetamide
CID 113230939
4-Methyl-1-[4-(propylamino)pentyl]pyrimidin-2-one
CID 114217379
N-(3-methoxypropyl)-2-(4-methyl-2-oxopyrimidin-1-yl)acetamide
CID 114217499
2-(2-oxopyrimidin-1-yl)-N-pentan-2-ylacetamide
CID 115579447
2-(2-oxopyrimidin-1-yl)-N-pentan-3-ylacetamide
CID 115580747
4-methyl-1-[[(2S)-pyrrolidin-2-yl]methyl]pyrimidin-2-one
CID 130485245

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(4-methyl-2-oxopyrimidin-1-yl)acetamide?
The IUPAC name of N-cyclopentyl-2-(4-methyl-2-oxopyrimidin-1-yl)acetamide (CID 113230936) is N-cyclopentyl-2-(4-methyl-2-oxopyrimidin-1-yl)acetamide.
What is the SMILES notation for N-cyclopentyl-2-(4-methyl-2-oxopyrimidin-1-yl)acetamide?
The canonical SMILES for N-cyclopentyl-2-(4-methyl-2-oxopyrimidin-1-yl)acetamide is Cc1ccn(CC(=O)NC2CCCC2)c(=O)n1.
What is the InChIKey of N-cyclopentyl-2-(4-methyl-2-oxopyrimidin-1-yl)acetamide?
The InChIKey is VMVPAAHGPOTRAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2/c1-9-6-7-15(12(17)13-9)8-11(16)14-10-4-2-3-5-10/h6-7,10H,2-5,8H2,1H3,(H,14,16).
What are the key properties of N-cyclopentyl-2-(4-methyl-2-oxopyrimidin-1-yl)acetamide?
N-cyclopentyl-2-(4-methyl-2-oxopyrimidin-1-yl)acetamide has a molecular weight of 235.29 g/mol, XLogP of 0.61, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(4-methyl-2-oxopyrimidin-1-yl)acetamide is sourced from PubChem (CID 113230936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).