5-(aminomethyl)-1-cyclopentylpyrimidin-4-one

C10H15N3O — CID 115114539

IUPAC5-(aminomethyl)-1-cyclopentylpyrimidin-4-one
SMILESNCc1cn(C2CCCC2)cnc1=O
InChIInChI=1S/C10H15N3O/c11-5-8-6-13(7-12-10(8)14)9-3-1-2-4-9/h6-7,9H,1-5,11H2
InChIKeyNJGIIADAWFJXHK-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.82
Rot. Bonds2

About 5-(aminomethyl)-1-cyclopentylpyrimidin-4-one

5-(aminomethyl)-1-cyclopentylpyrimidin-4-one (PubChem CID 115114539) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 5-(aminomethyl)-1-cyclopentylpyrimidin-4-one.

Molecular Properties

Compound Name5-(aminomethyl)-1-cyclopentylpyrimidin-4-one
PubChem CID115114539
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name5-(aminomethyl)-1-cyclopentylpyrimidin-4-one
SMILESNCc1cn(C2CCCC2)cnc1=O
InChIInChI=1S/C10H15N3O/c11-5-8-6-13(7-12-10(8)14)9-3-1-2-4-9/h6-7,9H,1-5,11H2
InChIKeyNJGIIADAWFJXHK-UHFFFAOYSA-N
XLogP0.82
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(Aminomethyl)-3-propan-2-ylpyrimidin-4-one
CID 83873643
N-cyclopentyl-6-oxo-1H-pyrimidine-5-carboxamide
CID 95916098
5-(Aminomethyl)-1-piperidin-4-ylpyrimidin-4-one
CID 115114244
5-(Aminomethyl)-1-(1-methylpiperidin-4-yl)pyrimidin-4-one
CID 115114245
5-(Aminomethyl)-1-(pyrrolidin-2-ylmethyl)pyrimidin-4-one
CID 115114316
5-(Aminomethyl)-1-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-4-one
CID 115114317
5-(Aminomethyl)-1-propylpyrimidin-4-one
CID 115114447
5-(Aminomethyl)-1-(2-methylpropyl)pyrimidin-4-one
CID 115114448
5-(Aminomethyl)-1-propan-2-ylpyrimidin-4-one
CID 115114461
5-(Aminomethyl)-1-tert-butylpyrimidin-4-one
CID 115114462
5-(Aminomethyl)-1-cyclopropylpyrimidin-4-one
CID 115114533
5-(Aminomethyl)-1-cyclobutylpyrimidin-4-one
CID 115114536

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-1-cyclopentylpyrimidin-4-one?
The IUPAC name of 5-(aminomethyl)-1-cyclopentylpyrimidin-4-one (CID 115114539) is 5-(aminomethyl)-1-cyclopentylpyrimidin-4-one.
What is the SMILES notation for 5-(aminomethyl)-1-cyclopentylpyrimidin-4-one?
The canonical SMILES for 5-(aminomethyl)-1-cyclopentylpyrimidin-4-one is NCc1cn(C2CCCC2)cnc1=O.
What is the InChIKey of 5-(aminomethyl)-1-cyclopentylpyrimidin-4-one?
The InChIKey is NJGIIADAWFJXHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c11-5-8-6-13(7-12-10(8)14)9-3-1-2-4-9/h6-7,9H,1-5,11H2.
What are the key properties of 5-(aminomethyl)-1-cyclopentylpyrimidin-4-one?
5-(aminomethyl)-1-cyclopentylpyrimidin-4-one has a molecular weight of 193.25 g/mol, XLogP of 0.82, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-1-cyclopentylpyrimidin-4-one is sourced from PubChem (CID 115114539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).