[1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-4-yl]methanamine

C14H24N4O — CID 112634703

IUPAC[1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-4-yl]methanamine
SMILESCCCOc1cc(C)nc(N2CCC(CN)CC2)n1
InChIInChI=1S/C14H24N4O/c1-3-8-19-13-9-11(2)16-14(17-13)18-6-4-12(10-15)5-7-18/h9,12H,3-8,10,15H2,1-2H3
InChIKeyJHADXOLWLNMXPZ-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.75
Rot. Bonds5

About [1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-4-yl]methanamine

[1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-4-yl]methanamine (PubChem CID 112634703) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is [1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-4-yl]methanamine.

Molecular Properties

Compound Name[1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-4-yl]methanamine
PubChem CID112634703
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name[1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-4-yl]methanamine
SMILESCCCOc1cc(C)nc(N2CCC(CN)CC2)n1
InChIInChI=1S/C14H24N4O/c1-3-8-19-13-9-11(2)16-14(17-13)18-6-4-12(10-15)5-7-18/h9,12H,3-8,10,15H2,1-2H3
InChIKeyJHADXOLWLNMXPZ-UHFFFAOYSA-N
XLogP1.75
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-1-[1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-4-yl]methanamine
CID 115973409
1-(4-methyl-6-propoxypyrimidin-2-yl)piperidine-4-carboxylic acid
CID 115972892
2-[1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-3-yl]ethanamine
CID 115973451
[4-(4-methyl-6-propoxypyrimidin-2-yl)morpholin-2-yl]methanamine
CID 112634676
[1-(4-methyl-6-propoxypyrimidin-2-yl)-4-methylsulfanylpiperidin-4-yl]methanamine
CID 115973341
1-[1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidin-4-yl]-N-methylmethanamine
CID 112634859
1-[1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidin-4-yl]ethanamine
CID 112634894
1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidin-4-ol
CID 3228712
1-(4-methyl-6-propoxypyrimidin-2-yl)-3-propylazetidin-3-amine
CID 112635869
1-[1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-2-yl]ethanamine
CID 115973416
2-[3-(chloromethyl)pyrrolidin-1-yl]-4-ethoxy-6-methylpyrimidine
CID 112635557
N-(cyclopropylmethyl)-1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidin-4-amine
CID 115973572

Frequently Asked Questions

What is the IUPAC name of [1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-4-yl]methanamine?
The IUPAC name of [1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-4-yl]methanamine (CID 112634703) is [1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-4-yl]methanamine.
What is the SMILES notation for [1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-4-yl]methanamine?
The canonical SMILES for [1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-4-yl]methanamine is CCCOc1cc(C)nc(N2CCC(CN)CC2)n1.
What is the InChIKey of [1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-4-yl]methanamine?
The InChIKey is JHADXOLWLNMXPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-8-19-13-9-11(2)16-14(17-13)18-6-4-12(10-15)5-7-18/h9,12H,3-8,10,15H2,1-2H3.
What are the key properties of [1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-4-yl]methanamine?
[1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-4-yl]methanamine has a molecular weight of 264.37 g/mol, XLogP of 1.75, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-methyl-6-propoxypyrimidin-2-yl)piperidin-4-yl]methanamine is sourced from PubChem (CID 112634703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).