3-hydroxy-2-imino-6-(4-piperidin-1-ylpiperidin-1-yl)pyrimidin-4-amine

C14H24N6O — CID 3068551

IUPAC3-hydroxy-2-imino-6-(4-piperidin-1-ylpiperidin-1-yl)pyrimidin-4-amine
SMILES[H]/N=c1\nc(N2CCC(N3CCCCC3)CC2)cc(N)n1O
InChIInChI=1S/C14H24N6O/c15-12-10-13(17-14(16)20(12)21)19-8-4-11(5-9-19)18-6-2-1-3-7-18/h10-11,16,21H,1-9,15H2/b16-14+
InChIKeyFPUXLPMXQUBUJJ-JQIJEIRASA-N
MW292.39 g/mol
LogP0.64
Rot. Bonds2

About 3-hydroxy-2-imino-6-(4-piperidin-1-ylpiperidin-1-yl)pyrimidin-4-amine

3-hydroxy-2-imino-6-(4-piperidin-1-ylpiperidin-1-yl)pyrimidin-4-amine (PubChem CID 3068551) has the molecular formula C14H24N6O and a molecular weight of 292.39 g/mol. Its IUPAC name is 3-hydroxy-2-imino-6-(4-piperidin-1-ylpiperidin-1-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name3-hydroxy-2-imino-6-(4-piperidin-1-ylpiperidin-1-yl)pyrimidin-4-amine
PubChem CID3068551
Molecular FormulaC14H24N6O
Molecular Weight292.39 g/mol
Exact Mass292.20
IUPAC Name3-hydroxy-2-imino-6-(4-piperidin-1-ylpiperidin-1-yl)pyrimidin-4-amine
SMILES[H]/N=c1\nc(N2CCC(N3CCCCC3)CC2)cc(N)n1O
InChIInChI=1S/C14H24N6O/c15-12-10-13(17-14(16)20(12)21)19-8-4-11(5-9-19)18-6-2-1-3-7-18/h10-11,16,21H,1-9,15H2/b16-14+
InChIKeyFPUXLPMXQUBUJJ-JQIJEIRASA-N
XLogP0.64
TPSA94.40 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.39
LogP ≤ 50.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}

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Related Compounds

Minoxidil
CID 4201
6-Amino-4-((1,4'-bipiperidin)-1'-yl)-2-iminopyrimidin-1(2H)-ol--hydrogen chloride (1/2)
CID 3068550
6-(1-Piperidinyl)pyrimidine-2,4-diamine 3-oxide
CID 135743713
2-Methyl-4-amino-6-piperidinopyrimidine 3-oxide
CID 15734618
Minoxidil hydrochloride
CID 16116765
Minoxidil Impurity 62
CID 20495860
CID 21217196
CID 21217196
1-Hydroxy-4-piperidin-1-ylpyrimidin-2-imine
CID 23200357
Tripotassium;3-hydroxy-2-imino-6-piperidin-1-ylpyrimidin-4-amine
CID 68525096
3-Hydroxy-2-imino-6-piperidin-1-ylpyrimidin-4-amine;dihydrochloride
CID 69304311
1-Hydroxy-4-piperidin-1-ylpyrimidine-2,2-diamine
CID 153967038
3-Hydroxy-2-imino-6-piperidin-1-ylpyrimidin-4-amine;1-hydroxy-4-piperidin-1-ylpyrimidin-2-imine
CID 157282950

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-2-imino-6-(4-piperidin-1-ylpiperidin-1-yl)pyrimidin-4-amine?
The IUPAC name of 3-hydroxy-2-imino-6-(4-piperidin-1-ylpiperidin-1-yl)pyrimidin-4-amine (CID 3068551) is 3-hydroxy-2-imino-6-(4-piperidin-1-ylpiperidin-1-yl)pyrimidin-4-amine.
What is the SMILES notation for 3-hydroxy-2-imino-6-(4-piperidin-1-ylpiperidin-1-yl)pyrimidin-4-amine?
The canonical SMILES for 3-hydroxy-2-imino-6-(4-piperidin-1-ylpiperidin-1-yl)pyrimidin-4-amine is [H]/N=c1\nc(N2CCC(N3CCCCC3)CC2)cc(N)n1O.
What is the InChIKey of 3-hydroxy-2-imino-6-(4-piperidin-1-ylpiperidin-1-yl)pyrimidin-4-amine?
The InChIKey is FPUXLPMXQUBUJJ-JQIJEIRASA-N. The full InChI is InChI=1S/C14H24N6O/c15-12-10-13(17-14(16)20(12)21)19-8-4-11(5-9-19)18-6-2-1-3-7-18/h10-11,16,21H,1-9,15H2/b16-14+.
What are the key properties of 3-hydroxy-2-imino-6-(4-piperidin-1-ylpiperidin-1-yl)pyrimidin-4-amine?
3-hydroxy-2-imino-6-(4-piperidin-1-ylpiperidin-1-yl)pyrimidin-4-amine has a molecular weight of 292.39 g/mol, XLogP of 0.64, 2 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-2-imino-6-(4-piperidin-1-ylpiperidin-1-yl)pyrimidin-4-amine is sourced from PubChem (CID 3068551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).