1-[5-(methoxymethyl)-4-methylpyrimidin-2-yl]piperidin-4-amine

C12H20N4O — CID 103278668

IUPAC1-[5-(methoxymethyl)-4-methylpyrimidin-2-yl]piperidin-4-amine
SMILESCOCc1cnc(N2CCC(N)CC2)nc1C
InChIInChI=1S/C12H20N4O/c1-9-10(8-17-2)7-14-12(15-9)16-5-3-11(13)4-6-16/h7,11H,3-6,8,13H2,1-2H3
InChIKeyIZPROEKRRGGDMQ-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.86
Rot. Bonds3

About 1-[5-(methoxymethyl)-4-methylpyrimidin-2-yl]piperidin-4-amine

1-[5-(methoxymethyl)-4-methylpyrimidin-2-yl]piperidin-4-amine (PubChem CID 103278668) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 1-[5-(methoxymethyl)-4-methylpyrimidin-2-yl]piperidin-4-amine.

Molecular Properties

Compound Name1-[5-(methoxymethyl)-4-methylpyrimidin-2-yl]piperidin-4-amine
PubChem CID103278668
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name1-[5-(methoxymethyl)-4-methylpyrimidin-2-yl]piperidin-4-amine
SMILESCOCc1cnc(N2CCC(N)CC2)nc1C
InChIInChI=1S/C12H20N4O/c1-9-10(8-17-2)7-14-12(15-9)16-5-3-11(13)4-6-16/h7,11H,3-6,8,13H2,1-2H3
InChIKeyIZPROEKRRGGDMQ-UHFFFAOYSA-N
XLogP0.86
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(chloromethyl)-2-[3-(methoxymethyl)pyrrolidin-1-yl]-4-methylpyrimidine
CID 83184845
5-(chloromethyl)-4-methyl-2-(4-methylpiperidin-1-yl)pyrimidine
CID 83184569
1-(4-methyl-5-phenylpyrimidin-2-yl)piperidin-4-amine
CID 103278594
N-[[2-[3-(methoxymethyl)pyrrolidin-1-yl]-4-methylpyrimidin-5-yl]methyl]cyclopropanamine
CID 83189314
[2-(azepan-1-yl)-4-methylpyrimidin-5-yl]methanamine
CID 83186430
5-(methoxymethyl)-2,4-dimethylpyrimidine
CID 54133369
N-[[4-methyl-2-(4-propan-2-ylpiperidin-1-yl)pyrimidin-5-yl]methyl]propan-1-amine
CID 103503036
2-(4-aminopiperidin-1-yl)-N-(2-methoxyethyl)pyrimidin-4-amine
CID 94672450
1-[2-(4-ethoxypiperidin-1-yl)-4-methylpyrimidin-5-yl]-N-methylmethanamine
CID 83186471
N,N-dimethyl-1-[4-methyl-5-(methylaminomethyl)pyrimidin-2-yl]piperidin-4-amine
CID 83185173
N-[[2-(4-ethoxypiperidin-1-yl)-4-methylpyrimidin-5-yl]methyl]ethanamine
CID 83185179
N-[[4-methyl-2-(4-propan-2-ylpiperidin-1-yl)pyrimidin-5-yl]methyl]cyclopropanamine
CID 103502946

Frequently Asked Questions

What is the IUPAC name of 1-[5-(methoxymethyl)-4-methylpyrimidin-2-yl]piperidin-4-amine?
The IUPAC name of 1-[5-(methoxymethyl)-4-methylpyrimidin-2-yl]piperidin-4-amine (CID 103278668) is 1-[5-(methoxymethyl)-4-methylpyrimidin-2-yl]piperidin-4-amine.
What is the SMILES notation for 1-[5-(methoxymethyl)-4-methylpyrimidin-2-yl]piperidin-4-amine?
The canonical SMILES for 1-[5-(methoxymethyl)-4-methylpyrimidin-2-yl]piperidin-4-amine is COCc1cnc(N2CCC(N)CC2)nc1C.
What is the InChIKey of 1-[5-(methoxymethyl)-4-methylpyrimidin-2-yl]piperidin-4-amine?
The InChIKey is IZPROEKRRGGDMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-9-10(8-17-2)7-14-12(15-9)16-5-3-11(13)4-6-16/h7,11H,3-6,8,13H2,1-2H3.
What are the key properties of 1-[5-(methoxymethyl)-4-methylpyrimidin-2-yl]piperidin-4-amine?
1-[5-(methoxymethyl)-4-methylpyrimidin-2-yl]piperidin-4-amine has a molecular weight of 236.32 g/mol, XLogP of 0.86, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(methoxymethyl)-4-methylpyrimidin-2-yl]piperidin-4-amine is sourced from PubChem (CID 103278668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).