2-methoxy-4-piperidin-4-yloxypyrimidine;hydrochloride

C10H16ClN3O2 — CID 141148252

IUPAC2-methoxy-4-piperidin-4-yloxypyrimidine;hydrochloride
SMILESCOc1nccc(OC2CCNCC2)n1.Cl
InChIInChI=1S/C10H15N3O2.ClH/c1-14-10-12-7-4-9(13-10)15-8-2-5-11-6-3-8;/h4,7-8,11H,2-3,5-6H2,1H3;1H
InChIKeyKTZMVEJNMGEBHI-UHFFFAOYSA-N
MW245.71 g/mol
LogP1.04
Rot. Bonds3

About 2-methoxy-4-piperidin-4-yloxypyrimidine;hydrochloride

2-methoxy-4-piperidin-4-yloxypyrimidine;hydrochloride (PubChem CID 141148252) has the molecular formula C10H16ClN3O2 and a molecular weight of 245.71 g/mol. Its IUPAC name is 2-methoxy-4-piperidin-4-yloxypyrimidine;hydrochloride.

Molecular Properties

Compound Name2-methoxy-4-piperidin-4-yloxypyrimidine;hydrochloride
PubChem CID141148252
Molecular FormulaC10H16ClN3O2
Molecular Weight245.71 g/mol
Exact Mass245.09
IUPAC Name2-methoxy-4-piperidin-4-yloxypyrimidine;hydrochloride
SMILESCOc1nccc(OC2CCNCC2)n1.Cl
InChIInChI=1S/C10H15N3O2.ClH/c1-14-10-12-7-4-9(13-10)15-8-2-5-11-6-3-8;/h4,7-8,11H,2-3,5-6H2,1H3;1H
InChIKeyKTZMVEJNMGEBHI-UHFFFAOYSA-N
XLogP1.04
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.71
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2,2-Dimethylpropoxy)pyrimidin-2-amine
CID 122536474
2,4-Diethoxypyrimidine
CID 224854
Pyrimidine, 2-amino-4-(2-dibutylaminoethoxy)-
CID 3025151
Pyrimidine, 2-amino-4-(2-diethylaminoethoxy)-
CID 3025152
4-Methoxy-2-(piperazin-1-yl)pyrimidine
CID 11480987
Pyrimidine, 4-isopropoxy-2-methyl-
CID 21630681
Pyrimidine, 2-amino-4-(2-dioctylaminoethoxy)-
CID 3025155
2-Chloro-4-ethoxypyrimidine
CID 4737280
2-Chloro-4-(2-methoxyethoxy)pyrimidine
CID 13861570
2-Chloro-4-propoxypyrimidine
CID 13869566
4-Ethoxy-2-(piperazin-1-yl)pyrimidine
CID 17855548
2-Chloro-4-(oxan-4-yloxy)pyrimidine
CID 51063929

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-piperidin-4-yloxypyrimidine;hydrochloride?
The IUPAC name of 2-methoxy-4-piperidin-4-yloxypyrimidine;hydrochloride (CID 141148252) is 2-methoxy-4-piperidin-4-yloxypyrimidine;hydrochloride.
What is the SMILES notation for 2-methoxy-4-piperidin-4-yloxypyrimidine;hydrochloride?
The canonical SMILES for 2-methoxy-4-piperidin-4-yloxypyrimidine;hydrochloride is COc1nccc(OC2CCNCC2)n1.Cl.
What is the InChIKey of 2-methoxy-4-piperidin-4-yloxypyrimidine;hydrochloride?
The InChIKey is KTZMVEJNMGEBHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2.ClH/c1-14-10-12-7-4-9(13-10)15-8-2-5-11-6-3-8;/h4,7-8,11H,2-3,5-6H2,1H3;1H.
What are the key properties of 2-methoxy-4-piperidin-4-yloxypyrimidine;hydrochloride?
2-methoxy-4-piperidin-4-yloxypyrimidine;hydrochloride has a molecular weight of 245.71 g/mol, XLogP of 1.04, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-piperidin-4-yloxypyrimidine;hydrochloride is sourced from PubChem (CID 141148252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).