5-amino-4-[[1-(hydroxymethyl)cyclopentyl]amino]-1H-pyrimidin-6-one

C10H16N4O2 — CID 136975415

IUPAC5-amino-4-[[1-(hydroxymethyl)cyclopentyl]amino]-1H-pyrimidin-6-one
SMILESNc1c(NC2(CO)CCCC2)nc[nH]c1=O
InChIInChI=1S/C10H16N4O2/c11-7-8(12-6-13-9(7)16)14-10(5-15)3-1-2-4-10/h6,15H,1-5,11H2,(H2,12,13,14,16)
InChIKeyKAZNNIIZEDZTNZ-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.07
Rot. Bonds3

About 5-amino-4-[[1-(hydroxymethyl)cyclopentyl]amino]-1H-pyrimidin-6-one

5-amino-4-[[1-(hydroxymethyl)cyclopentyl]amino]-1H-pyrimidin-6-one (PubChem CID 136975415) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 5-amino-4-[[1-(hydroxymethyl)cyclopentyl]amino]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name5-amino-4-[[1-(hydroxymethyl)cyclopentyl]amino]-1H-pyrimidin-6-one
PubChem CID136975415
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name5-amino-4-[[1-(hydroxymethyl)cyclopentyl]amino]-1H-pyrimidin-6-one
SMILESNc1c(NC2(CO)CCCC2)nc[nH]c1=O
InChIInChI=1S/C10H16N4O2/c11-7-8(12-6-13-9(7)16)14-10(5-15)3-1-2-4-10/h6,15H,1-5,11H2,(H2,12,13,14,16)
InChIKeyKAZNNIIZEDZTNZ-UHFFFAOYSA-N
XLogP0.07
TPSA104.03 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.07
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-4-[(2-hydroxy-4-methylpentyl)amino]-1H-pyrimidin-6-one
CID 136703841
5-amino-4-[[2-(hydroxymethyl)cyclopentyl]amino]-1H-pyrimidin-6-one
CID 136746821
5-amino-4-[(3-ethyl-2-hydroxypentyl)amino]-1H-pyrimidin-6-one
CID 136817765
5-amino-4-[(1-hydroxy-3-methylpentan-3-yl)amino]-1H-pyrimidin-6-one
CID 136849671
5-amino-4-(6-hydroxyhexylamino)-1H-pyrimidin-6-one
CID 136866826
5-amino-4-[(3-hydroxycyclopentyl)methylamino]-1H-pyrimidin-6-one
CID 136902395
4-[[1-(hydroxymethyl)cyclopentyl]amino]-5-iodo-1H-pyrimidin-6-one
CID 136956565
5-bromo-4-[[1-(hydroxymethyl)cyclopentyl]amino]-1H-pyrimidin-6-one
CID 136956567
4-[[1-(hydroxymethyl)cyclopentyl]amino]-1H-pyrimidin-6-one
CID 136956568
1-[(5-amino-6-oxo-1H-pyrimidin-4-yl)amino]cyclopentane-1-carboxylic acid
CID 136958605
5-amino-4-[(1-hydroxy-4-methylpentan-2-yl)amino]-1H-pyrimidin-6-one
CID 136974654
5-chloro-4-[[1-(hydroxymethyl)cyclopentyl]amino]-1H-pyrimidin-6-one
CID 136975417

Frequently Asked Questions

What is the IUPAC name of 5-amino-4-[[1-(hydroxymethyl)cyclopentyl]amino]-1H-pyrimidin-6-one?
The IUPAC name of 5-amino-4-[[1-(hydroxymethyl)cyclopentyl]amino]-1H-pyrimidin-6-one (CID 136975415) is 5-amino-4-[[1-(hydroxymethyl)cyclopentyl]amino]-1H-pyrimidin-6-one.
What is the SMILES notation for 5-amino-4-[[1-(hydroxymethyl)cyclopentyl]amino]-1H-pyrimidin-6-one?
The canonical SMILES for 5-amino-4-[[1-(hydroxymethyl)cyclopentyl]amino]-1H-pyrimidin-6-one is Nc1c(NC2(CO)CCCC2)nc[nH]c1=O.
What is the InChIKey of 5-amino-4-[[1-(hydroxymethyl)cyclopentyl]amino]-1H-pyrimidin-6-one?
The InChIKey is KAZNNIIZEDZTNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c11-7-8(12-6-13-9(7)16)14-10(5-15)3-1-2-4-10/h6,15H,1-5,11H2,(H2,12,13,14,16).
What are the key properties of 5-amino-4-[[1-(hydroxymethyl)cyclopentyl]amino]-1H-pyrimidin-6-one?
5-amino-4-[[1-(hydroxymethyl)cyclopentyl]amino]-1H-pyrimidin-6-one has a molecular weight of 224.26 g/mol, XLogP of 0.07, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-[[1-(hydroxymethyl)cyclopentyl]amino]-1H-pyrimidin-6-one is sourced from PubChem (CID 136975415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).