5-amino-2,4-dimethyl-1H-pyrimidin-6-one;hydrochloride

C6H10ClN3O — CID 135439769

IUPAC5-amino-2,4-dimethyl-1H-pyrimidin-6-one;hydrochloride
SMILESCc1nc(C)c(N)c(=O)[nH]1.Cl
InChIInChI=1S/C6H9N3O.ClH/c1-3-5(7)6(10)9-4(2)8-3;/h7H2,1-2H3,(H,8,9,10);1H
InChIKeyCNYQWFCYICVJOG-UHFFFAOYSA-N
MW175.62 g/mol
LogP0.39
Rot. Bonds

About 5-amino-2,4-dimethyl-1H-pyrimidin-6-one;hydrochloride

5-amino-2,4-dimethyl-1H-pyrimidin-6-one;hydrochloride (PubChem CID 135439769) has the molecular formula C6H10ClN3O and a molecular weight of 175.62 g/mol. Its IUPAC name is 5-amino-2,4-dimethyl-1H-pyrimidin-6-one;hydrochloride.

Molecular Properties

Compound Name5-amino-2,4-dimethyl-1H-pyrimidin-6-one;hydrochloride
PubChem CID135439769
Molecular FormulaC6H10ClN3O
Molecular Weight175.62 g/mol
Exact Mass175.05
IUPAC Name5-amino-2,4-dimethyl-1H-pyrimidin-6-one;hydrochloride
SMILESCc1nc(C)c(N)c(=O)[nH]1.Cl
InChIInChI=1S/C6H9N3O.ClH/c1-3-5(7)6(10)9-4(2)8-3;/h7H2,1-2H3,(H,8,9,10);1H
InChIKeyCNYQWFCYICVJOG-UHFFFAOYSA-N
XLogP0.39
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.62
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-amino-2,4-dimethyl-1H-pyrimidin-6-one;hydrochloride?
The IUPAC name of 5-amino-2,4-dimethyl-1H-pyrimidin-6-one;hydrochloride (CID 135439769) is 5-amino-2,4-dimethyl-1H-pyrimidin-6-one;hydrochloride.
What is the SMILES notation for 5-amino-2,4-dimethyl-1H-pyrimidin-6-one;hydrochloride?
The canonical SMILES for 5-amino-2,4-dimethyl-1H-pyrimidin-6-one;hydrochloride is Cc1nc(C)c(N)c(=O)[nH]1.Cl.
What is the InChIKey of 5-amino-2,4-dimethyl-1H-pyrimidin-6-one;hydrochloride?
The InChIKey is CNYQWFCYICVJOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O.ClH/c1-3-5(7)6(10)9-4(2)8-3;/h7H2,1-2H3,(H,8,9,10);1H.
What are the key properties of 5-amino-2,4-dimethyl-1H-pyrimidin-6-one;hydrochloride?
5-amino-2,4-dimethyl-1H-pyrimidin-6-one;hydrochloride has a molecular weight of 175.62 g/mol, XLogP of 0.39, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2,4-dimethyl-1H-pyrimidin-6-one;hydrochloride is sourced from PubChem (CID 135439769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).