2-amino-5-(cyclopropylamino)-4-hydroxy-1H-pyrimidin-6-one

C7H10N4O2 — CID 66803670

IUPAC2-amino-5-(cyclopropylamino)-4-hydroxy-1H-pyrimidin-6-one
SMILESNc1nc(O)c(NC2CC2)c(=O)[nH]1
InChIInChI=1S/C7H10N4O2/c8-7-10-5(12)4(6(13)11-7)9-3-1-2-3/h3,9H,1-2H2,(H4,8,10,11,12,13)
InChIKeyWKWQUOWGOHEPQP-UHFFFAOYSA-N
MW182.18 g/mol
LogP-0.37
Rot. Bonds2

About 2-amino-5-(cyclopropylamino)-4-hydroxy-1H-pyrimidin-6-one

2-amino-5-(cyclopropylamino)-4-hydroxy-1H-pyrimidin-6-one (PubChem CID 66803670) has the molecular formula C7H10N4O2 and a molecular weight of 182.18 g/mol. Its IUPAC name is 2-amino-5-(cyclopropylamino)-4-hydroxy-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-amino-5-(cyclopropylamino)-4-hydroxy-1H-pyrimidin-6-one
PubChem CID66803670
Molecular FormulaC7H10N4O2
Molecular Weight182.18 g/mol
Exact Mass182.08
IUPAC Name2-amino-5-(cyclopropylamino)-4-hydroxy-1H-pyrimidin-6-one
SMILESNc1nc(O)c(NC2CC2)c(=O)[nH]1
InChIInChI=1S/C7H10N4O2/c8-7-10-5(12)4(6(13)11-7)9-3-1-2-3/h3,9H,1-2H2,(H4,8,10,11,12,13)
InChIKeyWKWQUOWGOHEPQP-UHFFFAOYSA-N
XLogP-0.37
TPSA104.03 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 5-0.37
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

6-Methyltetrahydropterin
CID 135443397
2-Amino-6-aminomethyl-5,6,7,8-tetrahydro-3H-pteridin-4-one
CID 136035307
(6r)-2-Amino-6-Methyl-5,6,7,8-Tetrahydropteridin-4(3h)-One
CID 135564796
(6S)-2-Amino-6-methyl-5,6,7,8-tetrahydropteridin-4(1H)-one
CID 135564797
(6R)-2-amino-6-methanidyl-5,6,7,8-tetrahydro-3H-pteridin-4-one
CID 135567409
2-amino-4-hydroxy-5-(pentylamino)-1H-pyrimidin-6-one
CID 66758684
2-Amino-3,5,6,7,8,9-hexahydropyrimido[4,5-b][1,4]diazepin-4-one
CID 141145433
2-Amino-5-cyclopropyl-3,6,7,8-tetrahydropteridin-4-one
CID 175812526
2-Amino-6-hydroxy-5-(methylamino)pyrimidin-4(1H)-one
CID 45083170
5-(cyclopropylamino)-4-hydroxy-2-methyl-1H-pyrimidin-6-one
CID 132587841
5-(cyclopropylamino)-4-hydroxy-1H-pyrimidin-6-one
CID 132587842
2-Amino-6-methyl-3,5,6,8-tetrahydropteridine-4,7-dione
CID 135590519

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(cyclopropylamino)-4-hydroxy-1H-pyrimidin-6-one?
The IUPAC name of 2-amino-5-(cyclopropylamino)-4-hydroxy-1H-pyrimidin-6-one (CID 66803670) is 2-amino-5-(cyclopropylamino)-4-hydroxy-1H-pyrimidin-6-one.
What is the SMILES notation for 2-amino-5-(cyclopropylamino)-4-hydroxy-1H-pyrimidin-6-one?
The canonical SMILES for 2-amino-5-(cyclopropylamino)-4-hydroxy-1H-pyrimidin-6-one is Nc1nc(O)c(NC2CC2)c(=O)[nH]1.
What is the InChIKey of 2-amino-5-(cyclopropylamino)-4-hydroxy-1H-pyrimidin-6-one?
The InChIKey is WKWQUOWGOHEPQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4O2/c8-7-10-5(12)4(6(13)11-7)9-3-1-2-3/h3,9H,1-2H2,(H4,8,10,11,12,13).
What are the key properties of 2-amino-5-(cyclopropylamino)-4-hydroxy-1H-pyrimidin-6-one?
2-amino-5-(cyclopropylamino)-4-hydroxy-1H-pyrimidin-6-one has a molecular weight of 182.18 g/mol, XLogP of -0.37, 2 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(cyclopropylamino)-4-hydroxy-1H-pyrimidin-6-one is sourced from PubChem (CID 66803670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).