N-methyl-6-(1-methylpyrazol-4-yl)-2-(oxan-4-yl)pyrimidin-4-amine

C14H19N5O — CID 106715810

IUPACN-methyl-6-(1-methylpyrazol-4-yl)-2-(oxan-4-yl)pyrimidin-4-amine
SMILESCNc1cc(-c2cnn(C)c2)nc(C2CCOCC2)n1
InChIInChI=1S/C14H19N5O/c1-15-13-7-12(11-8-16-19(2)9-11)17-14(18-13)10-3-5-20-6-4-10/h7-10H,3-6H2,1-2H3,(H,15,17,18)
InChIKeyGKUFGFPCLKFODM-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.81
Rot. Bonds3

About N-methyl-6-(1-methylpyrazol-4-yl)-2-(oxan-4-yl)pyrimidin-4-amine

N-methyl-6-(1-methylpyrazol-4-yl)-2-(oxan-4-yl)pyrimidin-4-amine (PubChem CID 106715810) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is N-methyl-6-(1-methylpyrazol-4-yl)-2-(oxan-4-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-methyl-6-(1-methylpyrazol-4-yl)-2-(oxan-4-yl)pyrimidin-4-amine
PubChem CID106715810
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC NameN-methyl-6-(1-methylpyrazol-4-yl)-2-(oxan-4-yl)pyrimidin-4-amine
SMILESCNc1cc(-c2cnn(C)c2)nc(C2CCOCC2)n1
InChIInChI=1S/C14H19N5O/c1-15-13-7-12(11-8-16-19(2)9-11)17-14(18-13)10-3-5-20-6-4-10/h7-10H,3-6H2,1-2H3,(H,15,17,18)
InChIKeyGKUFGFPCLKFODM-UHFFFAOYSA-N
XLogP1.81
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-6-(1-methylpyrazol-4-yl)-2-pentan-3-ylpyrimidin-4-amine
CID 106716024
N-methyl-2-(oxan-4-yl)-6-propylpyrimidin-4-amine
CID 62385584
methyl 4-(methylamino)-6-(1-methylpyrazol-4-yl)pyrimidine-2-carboxylate
CID 106715741
2-butyl-N-methyl-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine
CID 106715837
2-cyclopropyl-6-N-methyl-4-N-[2-(1-methylpyrazol-4-yl)ethyl]pyrimidine-4,6-diamine
CID 80966249
N-methyl-6-(1-methylpyrazol-4-yl)-2-(3-methylthiophen-2-yl)pyrimidin-4-amine
CID 106716022
N-methyl-6-(1-methylpyrazol-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)pyrimidin-4-amine
CID 106716000
2-(2-chlorophenyl)-N-methyl-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine
CID 106715801
N-methyl-6-(1-methylpyrazol-4-yl)-2-(1H-1,2,4-triazol-5-yl)pyrimidin-4-amine
CID 106715777
N-methyl-6-(1-methylpyrazol-4-yl)-2-(4-methylthiophen-3-yl)pyrimidin-4-amine
CID 106715813
2-cyclopropyl-6-N-methyl-4-N-(2-morpholin-4-ylethyl)pyrimidine-4,6-diamine
CID 80956267
2-cyclopropyl-N-methyl-6-morpholin-4-ylpyrimidin-4-amine
CID 80956626

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(1-methylpyrazol-4-yl)-2-(oxan-4-yl)pyrimidin-4-amine?
The IUPAC name of N-methyl-6-(1-methylpyrazol-4-yl)-2-(oxan-4-yl)pyrimidin-4-amine (CID 106715810) is N-methyl-6-(1-methylpyrazol-4-yl)-2-(oxan-4-yl)pyrimidin-4-amine.
What is the SMILES notation for N-methyl-6-(1-methylpyrazol-4-yl)-2-(oxan-4-yl)pyrimidin-4-amine?
The canonical SMILES for N-methyl-6-(1-methylpyrazol-4-yl)-2-(oxan-4-yl)pyrimidin-4-amine is CNc1cc(-c2cnn(C)c2)nc(C2CCOCC2)n1.
What is the InChIKey of N-methyl-6-(1-methylpyrazol-4-yl)-2-(oxan-4-yl)pyrimidin-4-amine?
The InChIKey is GKUFGFPCLKFODM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c1-15-13-7-12(11-8-16-19(2)9-11)17-14(18-13)10-3-5-20-6-4-10/h7-10H,3-6H2,1-2H3,(H,15,17,18).
What are the key properties of N-methyl-6-(1-methylpyrazol-4-yl)-2-(oxan-4-yl)pyrimidin-4-amine?
N-methyl-6-(1-methylpyrazol-4-yl)-2-(oxan-4-yl)pyrimidin-4-amine has a molecular weight of 273.34 g/mol, XLogP of 1.81, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(1-methylpyrazol-4-yl)-2-(oxan-4-yl)pyrimidin-4-amine is sourced from PubChem (CID 106715810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).