6-methoxy-5-methyl-N-(2-methylpiperidin-3-yl)pyrimidin-4-amine

C12H20N4O — CID 114695492

IUPAC6-methoxy-5-methyl-N-(2-methylpiperidin-3-yl)pyrimidin-4-amine
SMILESCOc1ncnc(NC2CCCNC2C)c1C
InChIInChI=1S/C12H20N4O/c1-8-11(14-7-15-12(8)17-3)16-10-5-4-6-13-9(10)2/h7,9-10,13H,4-6H2,1-3H3,(H,14,15,16)
InChIKeySKTJLZSZYXFCNO-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.35
Rot. Bonds3

About 6-methoxy-5-methyl-N-(2-methylpiperidin-3-yl)pyrimidin-4-amine

6-methoxy-5-methyl-N-(2-methylpiperidin-3-yl)pyrimidin-4-amine (PubChem CID 114695492) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 6-methoxy-5-methyl-N-(2-methylpiperidin-3-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-methoxy-5-methyl-N-(2-methylpiperidin-3-yl)pyrimidin-4-amine
PubChem CID114695492
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name6-methoxy-5-methyl-N-(2-methylpiperidin-3-yl)pyrimidin-4-amine
SMILESCOc1ncnc(NC2CCCNC2C)c1C
InChIInChI=1S/C12H20N4O/c1-8-11(14-7-15-12(8)17-3)16-10-5-4-6-13-9(10)2/h7,9-10,13H,4-6H2,1-3H3,(H,14,15,16)
InChIKeySKTJLZSZYXFCNO-UHFFFAOYSA-N
XLogP1.35
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-methoxy-5-methyl-N-piperidin-3-ylpyrimidin-4-amine
CID 66332962
[2-[(6-methoxy-5-methylpyrimidin-4-yl)amino]cyclopentyl]methanol
CID 114178800
N-(2-methylpiperidin-3-yl)-5,6,7,8-tetrahydroquinazolin-4-amine
CID 114695362
4-methoxy-5-methyl-6-pyrrolidin-2-ylpyrimidine
CID 82656761
6-methoxy-N-(3-methoxycyclopentyl)-5-methylpyrimidin-4-amine
CID 114118126
6-methoxy-5-methyl-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidin-4-amine
CID 103967116
N-(2-chlorocyclohexyl)-6-ethoxy-5-methylpyrimidin-4-amine
CID 66324741
6-methoxy-5-methyl-N-(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)pyrimidin-4-amine
CID 66327688
N-(2-methylpiperidin-3-yl)-6-nitroquinazolin-4-amine
CID 114695488
6-methoxy-N-(2-methylpiperidin-3-yl)-3-nitropyridin-2-amine
CID 114695495
5-iodo-N-(2-methylpiperidin-3-yl)pyrimidin-2-amine
CID 114695529
N-(2-methylpiperidin-3-yl)-1,3,4-thiadiazol-2-amine
CID 114695446

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-5-methyl-N-(2-methylpiperidin-3-yl)pyrimidin-4-amine?
The IUPAC name of 6-methoxy-5-methyl-N-(2-methylpiperidin-3-yl)pyrimidin-4-amine (CID 114695492) is 6-methoxy-5-methyl-N-(2-methylpiperidin-3-yl)pyrimidin-4-amine.
What is the SMILES notation for 6-methoxy-5-methyl-N-(2-methylpiperidin-3-yl)pyrimidin-4-amine?
The canonical SMILES for 6-methoxy-5-methyl-N-(2-methylpiperidin-3-yl)pyrimidin-4-amine is COc1ncnc(NC2CCCNC2C)c1C.
What is the InChIKey of 6-methoxy-5-methyl-N-(2-methylpiperidin-3-yl)pyrimidin-4-amine?
The InChIKey is SKTJLZSZYXFCNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-8-11(14-7-15-12(8)17-3)16-10-5-4-6-13-9(10)2/h7,9-10,13H,4-6H2,1-3H3,(H,14,15,16).
What are the key properties of 6-methoxy-5-methyl-N-(2-methylpiperidin-3-yl)pyrimidin-4-amine?
6-methoxy-5-methyl-N-(2-methylpiperidin-3-yl)pyrimidin-4-amine has a molecular weight of 236.32 g/mol, XLogP of 1.35, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-5-methyl-N-(2-methylpiperidin-3-yl)pyrimidin-4-amine is sourced from PubChem (CID 114695492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).