5-amino-4-[2-(aminomethyl)cyclopentyl]oxy-1H-pyrimidin-6-one

C10H16N4O2 — CID 114586508

IUPAC5-amino-4-[2-(aminomethyl)cyclopentyl]oxy-1H-pyrimidin-6-one
SMILESNCC1CCCC1Oc1nc[nH]c(=O)c1N
InChIInChI=1S/C10H16N4O2/c11-4-6-2-1-3-7(6)16-10-8(12)9(15)13-5-14-10/h5-7H,1-4,11-12H2,(H,13,14,15)
InChIKeyQSUVAGFGRKCKNG-UHFFFAOYSA-N
MW224.26 g/mol
LogP-0.14
Rot. Bonds3

About 5-amino-4-[2-(aminomethyl)cyclopentyl]oxy-1H-pyrimidin-6-one

5-amino-4-[2-(aminomethyl)cyclopentyl]oxy-1H-pyrimidin-6-one (PubChem CID 114586508) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 5-amino-4-[2-(aminomethyl)cyclopentyl]oxy-1H-pyrimidin-6-one.

Molecular Properties

Compound Name5-amino-4-[2-(aminomethyl)cyclopentyl]oxy-1H-pyrimidin-6-one
PubChem CID114586508
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name5-amino-4-[2-(aminomethyl)cyclopentyl]oxy-1H-pyrimidin-6-one
SMILESNCC1CCCC1Oc1nc[nH]c(=O)c1N
InChIInChI=1S/C10H16N4O2/c11-4-6-2-1-3-7(6)16-10-8(12)9(15)13-5-14-10/h5-7H,1-4,11-12H2,(H,13,14,15)
InChIKeyQSUVAGFGRKCKNG-UHFFFAOYSA-N
XLogP-0.14
TPSA107.02 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 5-amino-4-[2-(aminomethyl)cyclopentyl]oxy-1H-pyrimidin-6-one 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

5-amino-4-(cyclopentylmethoxy)-1H-pyrimidin-6-one
CID 103241758
5-amino-4-[[2-(aminomethyl)cyclopentyl]methoxy]-1H-pyrimidin-6-one
CID 113604894
5-amino-4-(2-piperidin-3-ylethoxy)-1H-pyrimidin-6-one
CID 114586439
5-amino-4-[(1-aminocyclopentyl)methoxy]-1H-pyrimidin-6-one
CID 114586465
4-[2-(aminomethyl)cyclopentyl]oxy-5-chloro-1H-pyrimidin-6-one
CID 114586503
4-[2-(aminomethyl)cyclopentyl]oxy-1H-pyrimidin-6-one
CID 114586504
4-[2-(aminomethyl)cyclopentyl]oxy-5-bromo-1H-pyrimidin-6-one
CID 114586507
4-[2-(aminomethyl)cyclopentyl]oxy-5-iodo-1H-pyrimidin-6-one
CID 114586510
5-amino-4-[2-(aminomethyl)cyclohexyl]oxy-1H-pyrimidin-6-one
CID 114586517
5-amino-4-(3-aminocyclopentyl)oxy-1H-pyrimidin-6-one
CID 114586568
5-amino-4-[(2-ethyloxolan-3-yl)methylamino]-1H-pyrimidin-6-one
CID 136905795
5-amino-4-[(2-hydroxycyclopentyl)methylamino]-1H-pyrimidin-6-one
CID 136976186

Frequently Asked Questions

What is the IUPAC name of 5-amino-4-[2-(aminomethyl)cyclopentyl]oxy-1H-pyrimidin-6-one?
The IUPAC name of 5-amino-4-[2-(aminomethyl)cyclopentyl]oxy-1H-pyrimidin-6-one (CID 114586508) is 5-amino-4-[2-(aminomethyl)cyclopentyl]oxy-1H-pyrimidin-6-one.
What is the SMILES notation for 5-amino-4-[2-(aminomethyl)cyclopentyl]oxy-1H-pyrimidin-6-one?
The canonical SMILES for 5-amino-4-[2-(aminomethyl)cyclopentyl]oxy-1H-pyrimidin-6-one is NCC1CCCC1Oc1nc[nH]c(=O)c1N.
What is the InChIKey of 5-amino-4-[2-(aminomethyl)cyclopentyl]oxy-1H-pyrimidin-6-one?
The InChIKey is QSUVAGFGRKCKNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c11-4-6-2-1-3-7(6)16-10-8(12)9(15)13-5-14-10/h5-7H,1-4,11-12H2,(H,13,14,15).
What are the key properties of 5-amino-4-[2-(aminomethyl)cyclopentyl]oxy-1H-pyrimidin-6-one?
5-amino-4-[2-(aminomethyl)cyclopentyl]oxy-1H-pyrimidin-6-one has a molecular weight of 224.26 g/mol, XLogP of -0.14, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-[2-(aminomethyl)cyclopentyl]oxy-1H-pyrimidin-6-one is sourced from PubChem (CID 114586508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).