1-(6-propoxypyrimidin-4-yl)piperidin-3-amine

C12H20N4O — CID 66333796

IUPAC1-(6-propoxypyrimidin-4-yl)piperidin-3-amine
SMILESCCCOc1cc(N2CCCC(N)C2)ncn1
InChIInChI=1S/C12H20N4O/c1-2-6-17-12-7-11(14-9-15-12)16-5-3-4-10(13)8-16/h7,9-10H,2-6,8,13H2,1H3
InChIKeyNURAAJXYPKXGGU-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.19
Rot. Bonds4

About 1-(6-propoxypyrimidin-4-yl)piperidin-3-amine

1-(6-propoxypyrimidin-4-yl)piperidin-3-amine (PubChem CID 66333796) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 1-(6-propoxypyrimidin-4-yl)piperidin-3-amine.

Molecular Properties

Compound Name1-(6-propoxypyrimidin-4-yl)piperidin-3-amine
PubChem CID66333796
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name1-(6-propoxypyrimidin-4-yl)piperidin-3-amine
SMILESCCCOc1cc(N2CCCC(N)C2)ncn1
InChIInChI=1S/C12H20N4O/c1-2-6-17-12-7-11(14-9-15-12)16-5-3-4-10(13)8-16/h7,9-10H,2-6,8,13H2,1H3
InChIKeyNURAAJXYPKXGGU-UHFFFAOYSA-N
XLogP1.19
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[1-(6-propoxypyrimidin-4-yl)piperidin-3-yl]ethanamine
CID 66331369
N-[[1-(6-propoxypyrimidin-4-yl)piperidin-3-yl]methyl]ethanamine
CID 66331580
[1-(6-propoxypyrimidin-4-yl)pyrrolidin-3-yl]methanamine
CID 66334205
2-[1-(6-propoxypyrimidin-4-yl)piperidin-3-yl]acetic acid
CID 66331557
4-[3-(chloromethyl)pyrrolidin-1-yl]-6-propoxypyrimidine
CID 66334023
6-[(3R)-3-aminopiperidin-1-yl]-N,N-diethylpyrimidin-4-amine
CID 86318094
N-methyl-1-[1-(6-propoxypyrimidin-4-yl)piperidin-4-yl]methanamine
CID 66332385
(3R)-1-(6-methylsulfanylpyrimidin-4-yl)piperidin-3-amine
CID 106973343
6-(3-aminopiperidin-1-yl)-N,N-dimethylpyrimidin-4-amine
CID 53185813
[4-methyl-1-(6-propoxypyrimidin-4-yl)piperazin-2-yl]methanamine
CID 80506286
[6-methyl-4-(6-propoxypyrimidin-4-yl)morpholin-2-yl]methanamine
CID 102938720
1-(6-ethoxypyrimidin-4-yl)-4-methylpiperidin-3-ol
CID 86797858

Frequently Asked Questions

What is the IUPAC name of 1-(6-propoxypyrimidin-4-yl)piperidin-3-amine?
The IUPAC name of 1-(6-propoxypyrimidin-4-yl)piperidin-3-amine (CID 66333796) is 1-(6-propoxypyrimidin-4-yl)piperidin-3-amine.
What is the SMILES notation for 1-(6-propoxypyrimidin-4-yl)piperidin-3-amine?
The canonical SMILES for 1-(6-propoxypyrimidin-4-yl)piperidin-3-amine is CCCOc1cc(N2CCCC(N)C2)ncn1.
What is the InChIKey of 1-(6-propoxypyrimidin-4-yl)piperidin-3-amine?
The InChIKey is NURAAJXYPKXGGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-2-6-17-12-7-11(14-9-15-12)16-5-3-4-10(13)8-16/h7,9-10H,2-6,8,13H2,1H3.
What are the key properties of 1-(6-propoxypyrimidin-4-yl)piperidin-3-amine?
1-(6-propoxypyrimidin-4-yl)piperidin-3-amine has a molecular weight of 236.32 g/mol, XLogP of 1.19, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-propoxypyrimidin-4-yl)piperidin-3-amine is sourced from PubChem (CID 66333796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).