6-(aminomethyl)-4-cyclopentyl-1H-pyrimidin-2-one

C10H15N3O — CID 82401904

IUPAC6-(aminomethyl)-4-cyclopentyl-1H-pyrimidin-2-one
SMILESNCc1cc(C2CCCC2)nc(=O)[nH]1
InChIInChI=1S/C10H15N3O/c11-6-8-5-9(13-10(14)12-8)7-3-1-2-4-7/h5,7H,1-4,6,11H2,(H,12,13,14)
InChIKeyBHVKUGSRWSODLN-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.89
Rot. Bonds2

About 6-(aminomethyl)-4-cyclopentyl-1H-pyrimidin-2-one

6-(aminomethyl)-4-cyclopentyl-1H-pyrimidin-2-one (PubChem CID 82401904) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 6-(aminomethyl)-4-cyclopentyl-1H-pyrimidin-2-one.

Molecular Properties

Compound Name6-(aminomethyl)-4-cyclopentyl-1H-pyrimidin-2-one
PubChem CID82401904
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name6-(aminomethyl)-4-cyclopentyl-1H-pyrimidin-2-one
SMILESNCc1cc(C2CCCC2)nc(=O)[nH]1
InChIInChI=1S/C10H15N3O/c11-6-8-5-9(13-10(14)12-8)7-3-1-2-4-7/h5,7H,1-4,6,11H2,(H,12,13,14)
InChIKeyBHVKUGSRWSODLN-UHFFFAOYSA-N
XLogP0.89
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-(aminomethyl)-4-(2-methylpropyl)-1H-pyrimidin-2-one
CID 82408358
6-(aminomethyl)-4-propan-2-yl-1H-pyrimidin-2-one
CID 82413785
6-(aminomethyl)-4-cyclopropyl-1H-pyrimidin-2-one
CID 82414638
6-(aminomethyl)-4-cyclobutyl-1H-pyrimidin-2-one
CID 83846398
4-cyclopropyl-6-(methylaminomethyl)-1H-pyrimidin-2-one
CID 83846399
4-(1-amino-2-methylpropyl)-6-methyl-1H-pyrimidin-2-one
CID 83846623
6-(1-aminoethyl)-4-propan-2-yl-1H-pyrimidin-2-one
CID 83846624
6-(methylaminomethyl)-4-propan-2-yl-1H-pyrimidin-2-one
CID 83846629
4-cyclobutyl-6-(methylaminomethyl)-1H-pyrimidin-2-one
CID 83847326
4-(1-aminoethyl)-6-cyclopentyl-1H-pyrimidin-2-one
CID 83848472
6-(2-aminoethyl)-4-cyclopentyl-1H-pyrimidin-2-one
CID 83848478
4-cyclopentyl-6-(methylaminomethyl)-1H-pyrimidin-2-one
CID 83848485

Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-4-cyclopentyl-1H-pyrimidin-2-one?
The IUPAC name of 6-(aminomethyl)-4-cyclopentyl-1H-pyrimidin-2-one (CID 82401904) is 6-(aminomethyl)-4-cyclopentyl-1H-pyrimidin-2-one.
What is the SMILES notation for 6-(aminomethyl)-4-cyclopentyl-1H-pyrimidin-2-one?
The canonical SMILES for 6-(aminomethyl)-4-cyclopentyl-1H-pyrimidin-2-one is NCc1cc(C2CCCC2)nc(=O)[nH]1.
What is the InChIKey of 6-(aminomethyl)-4-cyclopentyl-1H-pyrimidin-2-one?
The InChIKey is BHVKUGSRWSODLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c11-6-8-5-9(13-10(14)12-8)7-3-1-2-4-7/h5,7H,1-4,6,11H2,(H,12,13,14).
What are the key properties of 6-(aminomethyl)-4-cyclopentyl-1H-pyrimidin-2-one?
6-(aminomethyl)-4-cyclopentyl-1H-pyrimidin-2-one has a molecular weight of 193.25 g/mol, XLogP of 0.89, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-4-cyclopentyl-1H-pyrimidin-2-one is sourced from PubChem (CID 82401904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).