N-cyclopentyl-2,4,6-trimethylpyrimidine-5-carboxamide

C13H19N3O — CID 110848761

IUPACN-cyclopentyl-2,4,6-trimethylpyrimidine-5-carboxamide
SMILESCc1nc(C)c(C(=O)NC2CCCC2)c(C)n1
InChIInChI=1S/C13H19N3O/c1-8-12(9(2)15-10(3)14-8)13(17)16-11-6-4-5-7-11/h11H,4-7H2,1-3H3,(H,16,17)
InChIKeyHFGYOZHHNNAKRK-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.07
Rot. Bonds2

About N-cyclopentyl-2,4,6-trimethylpyrimidine-5-carboxamide

N-cyclopentyl-2,4,6-trimethylpyrimidine-5-carboxamide (PubChem CID 110848761) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is N-cyclopentyl-2,4,6-trimethylpyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-2,4,6-trimethylpyrimidine-5-carboxamide
PubChem CID110848761
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC NameN-cyclopentyl-2,4,6-trimethylpyrimidine-5-carboxamide
SMILESCc1nc(C)c(C(=O)NC2CCCC2)c(C)n1
InChIInChI=1S/C13H19N3O/c1-8-12(9(2)15-10(3)14-8)13(17)16-11-6-4-5-7-11/h11H,4-7H2,1-3H3,(H,16,17)
InChIKeyHFGYOZHHNNAKRK-UHFFFAOYSA-N
XLogP2.07
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-2,4-dimethyl-6-methylsulfanylpyrimidine-5-carboxamide
CID 64593244
N-cyclohexyl-2,4-dimethyl-6-oxo-1H-pyrimidine-5-carboxamide
CID 136911212
N-cycloheptyl-2,4-dimethyl-6-oxo-1H-pyrimidine-5-carboxamide
CID 136890080
N-cyclooctyl-2,4-dimethylpyrimidine-5-carboxamide
CID 66877554
N-cycloheptyl-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 43582836
N-cycloheptyl-2,4-dimethyl-1,3-thiazole-5-carboxamide
CID 9123260
2-chloro-N-cycloheptyl-4-methyl-1,3-thiazole-5-carboxamide
CID 91821812
N-cyclopentyl-2-fluoro-4-hydroxy-6-methylbenzamide
CID 171905657
N-cyclohexyl-2,3,4,5,6-pentafluorobenzamide
CID 607051
N-cycloheptyl-2-methylquinazoline-4-carboxamide
CID 110702850
N-cyclopentyl-2-(cyclopropylamino)-4-methyl-1,3-thiazole-5-carboxamide
CID 45495297
N-cyclohexyl-4-methyl-2-(methylamino)-1,3-thiazole-5-carboxamide
CID 110386309

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2,4,6-trimethylpyrimidine-5-carboxamide?
The IUPAC name of N-cyclopentyl-2,4,6-trimethylpyrimidine-5-carboxamide (CID 110848761) is N-cyclopentyl-2,4,6-trimethylpyrimidine-5-carboxamide.
What is the SMILES notation for N-cyclopentyl-2,4,6-trimethylpyrimidine-5-carboxamide?
The canonical SMILES for N-cyclopentyl-2,4,6-trimethylpyrimidine-5-carboxamide is Cc1nc(C)c(C(=O)NC2CCCC2)c(C)n1.
What is the InChIKey of N-cyclopentyl-2,4,6-trimethylpyrimidine-5-carboxamide?
The InChIKey is HFGYOZHHNNAKRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-8-12(9(2)15-10(3)14-8)13(17)16-11-6-4-5-7-11/h11H,4-7H2,1-3H3,(H,16,17).
What are the key properties of N-cyclopentyl-2,4,6-trimethylpyrimidine-5-carboxamide?
N-cyclopentyl-2,4,6-trimethylpyrimidine-5-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 2.07, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2,4,6-trimethylpyrimidine-5-carboxamide is sourced from PubChem (CID 110848761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).