3-ethyl-1-(4-propoxypyrimidin-2-yl)piperidin-4-amine

C14H24N4O — CID 112638807

IUPAC3-ethyl-1-(4-propoxypyrimidin-2-yl)piperidin-4-amine
SMILESCCCOc1ccnc(N2CCC(N)C(CC)C2)n1
InChIInChI=1S/C14H24N4O/c1-3-9-19-13-5-7-16-14(17-13)18-8-6-12(15)11(4-2)10-18/h5,7,11-12H,3-4,6,8-10,15H2,1-2H3
InChIKeyDQRKWADQAUCJGJ-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.83
Rot. Bonds5

About 3-ethyl-1-(4-propoxypyrimidin-2-yl)piperidin-4-amine

3-ethyl-1-(4-propoxypyrimidin-2-yl)piperidin-4-amine (PubChem CID 112638807) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 3-ethyl-1-(4-propoxypyrimidin-2-yl)piperidin-4-amine.

Molecular Properties

Compound Name3-ethyl-1-(4-propoxypyrimidin-2-yl)piperidin-4-amine
PubChem CID112638807
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name3-ethyl-1-(4-propoxypyrimidin-2-yl)piperidin-4-amine
SMILESCCCOc1ccnc(N2CCC(N)C(CC)C2)n1
InChIInChI=1S/C14H24N4O/c1-3-9-19-13-5-7-16-14(17-13)18-8-6-12(15)11(4-2)10-18/h5,7,11-12H,3-4,6,8-10,15H2,1-2H3
InChIKeyDQRKWADQAUCJGJ-UHFFFAOYSA-N
XLogP1.83
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 ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-bromo-3-methylpiperidin-1-yl)-4-propoxypyrimidine
CID 114682716
N-[[1-(4-propoxypyrimidin-2-yl)piperidin-3-yl]methyl]cyclopropanamine
CID 115975651
2-methyl-1-(4-propoxypyrimidin-2-yl)piperidin-4-amine
CID 112638848
1-(4-ethoxypyrimidin-2-yl)-4-methylpyrrolidin-3-amine
CID 103577741
2-[1-(4-ethoxypyrimidin-2-yl)pyrrolidin-3-yl]propan-2-ol
CID 131916729
[6-methyl-1-(4-propoxypyrimidin-2-yl)piperidin-3-yl]methanamine
CID 112638683
ethyl 1-(4-propoxypyrimidin-2-yl)pyrrolidine-2-carboxylate
CID 115975575
1-(4-amino-3-ethylpiperidin-1-yl)isoquinolin-7-ol
CID 106540925
3-ethyl-1-(5-methoxyisoquinolin-1-yl)piperidin-4-amine
CID 106540923
N-methyl-1-[3-methyl-1-(4-propoxypyrimidin-2-yl)pyrrolidin-3-yl]methanamine
CID 106321862
N-[(1S)-1-[4-[1-(4-propoxypyrimidin-2-yl)piperidin-4-yl]phenyl]ethyl]acetamide
CID 67988092
4-ethoxy-2-pyrrolidin-1-ylpyrimidine
CID 59525896

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(4-propoxypyrimidin-2-yl)piperidin-4-amine?
The IUPAC name of 3-ethyl-1-(4-propoxypyrimidin-2-yl)piperidin-4-amine (CID 112638807) is 3-ethyl-1-(4-propoxypyrimidin-2-yl)piperidin-4-amine.
What is the SMILES notation for 3-ethyl-1-(4-propoxypyrimidin-2-yl)piperidin-4-amine?
The canonical SMILES for 3-ethyl-1-(4-propoxypyrimidin-2-yl)piperidin-4-amine is CCCOc1ccnc(N2CCC(N)C(CC)C2)n1.
What is the InChIKey of 3-ethyl-1-(4-propoxypyrimidin-2-yl)piperidin-4-amine?
The InChIKey is DQRKWADQAUCJGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-9-19-13-5-7-16-14(17-13)18-8-6-12(15)11(4-2)10-18/h5,7,11-12H,3-4,6,8-10,15H2,1-2H3.
What are the key properties of 3-ethyl-1-(4-propoxypyrimidin-2-yl)piperidin-4-amine?
3-ethyl-1-(4-propoxypyrimidin-2-yl)piperidin-4-amine has a molecular weight of 264.37 g/mol, XLogP of 1.83, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(4-propoxypyrimidin-2-yl)piperidin-4-amine is sourced from PubChem (CID 112638807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).