4-methoxy-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine

C10H17N5O — CID 25129178

IUPAC4-methoxy-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine
SMILESCOc1cc(N2CCN(C)CC2)nc(N)n1
InChIInChI=1S/C10H17N5O/c1-14-3-5-15(6-4-14)8-7-9(16-2)13-10(11)12-8/h7H,3-6H2,1-2H3,(H2,11,12,13)
InChIKeyVDDOXGRJCNNUMV-UHFFFAOYSA-N
MW223.28 g/mol
LogP-0.18
Rot. Bonds2

About 4-methoxy-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine

4-methoxy-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine (PubChem CID 25129178) has the molecular formula C10H17N5O and a molecular weight of 223.28 g/mol. Its IUPAC name is 4-methoxy-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-methoxy-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine
PubChem CID25129178
Molecular FormulaC10H17N5O
Molecular Weight223.28 g/mol
Exact Mass223.14
IUPAC Name4-methoxy-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine
SMILESCOc1cc(N2CCN(C)CC2)nc(N)n1
InChIInChI=1S/C10H17N5O/c1-14-3-5-15(6-4-14)8-7-9(16-2)13-10(11)12-8/h7H,3-6H2,1-2H3,(H2,11,12,13)
InChIKeyVDDOXGRJCNNUMV-UHFFFAOYSA-N
XLogP-0.18
TPSA67.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 5-0.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2,6-Dimethoxy-4-aminopyrimidine
CID 76789
2,4-Diamino-6-methoxypyrimidine
CID 816925
4-(6-Methoxypyrimidin-4-yl)morpholine
CID 3242788
4,6-Dimethoxy-2-piperidin-1-ylpyrimidine
CID 90342172
6-Methoxy-2-methylpyrimidin-4-amine
CID 549435
Pyrimidine, 2,4-diamino-6-(2-(dimethylamino)ethoxy)-
CID 202116
Pyrimidine, 2,4-diamino-6-(2-(diethylamino)ethoxy)-
CID 202117
4-Methoxy-2-(piperazin-1-yl)pyrimidine
CID 11480987
4,6-Dimethoxy-2-(piperazin-1-ylmethyl)pyrimidine
CID 2736218
4-Methoxy-6-(piperazin-1-yl)pyrimidine
CID 45789017
4-(4,6-dimethoxypyrimidin-2-yl)-N,N-dimethylpiperazine-1-sulfonamide
CID 25269752
4-N-butyl-6-methoxypyrimidine-2,4-diamine
CID 103817396

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine?
The IUPAC name of 4-methoxy-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine (CID 25129178) is 4-methoxy-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine.
What is the SMILES notation for 4-methoxy-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine?
The canonical SMILES for 4-methoxy-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine is COc1cc(N2CCN(C)CC2)nc(N)n1.
What is the InChIKey of 4-methoxy-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine?
The InChIKey is VDDOXGRJCNNUMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O/c1-14-3-5-15(6-4-14)8-7-9(16-2)13-10(11)12-8/h7H,3-6H2,1-2H3,(H2,11,12,13).
What are the key properties of 4-methoxy-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine?
4-methoxy-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine has a molecular weight of 223.28 g/mol, XLogP of -0.18, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-6-(4-methylpiperazin-1-yl)pyrimidin-2-amine is sourced from PubChem (CID 25129178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).