4-methoxy-6-(2-pyrrolidin-2-ylpiperidin-1-yl)pyrimidine

C14H22N4O — CID 66318975

IUPAC4-methoxy-6-(2-pyrrolidin-2-ylpiperidin-1-yl)pyrimidine
SMILESCOc1cc(N2CCCCC2C2CCCN2)ncn1
InChIInChI=1S/C14H22N4O/c1-19-14-9-13(16-10-17-14)18-8-3-2-6-12(18)11-5-4-7-15-11/h9-12,15H,2-8H2,1H3
InChIKeyPMZMTIRIJKQJES-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.60
Rot. Bonds3

About 4-methoxy-6-(2-pyrrolidin-2-ylpiperidin-1-yl)pyrimidine

4-methoxy-6-(2-pyrrolidin-2-ylpiperidin-1-yl)pyrimidine (PubChem CID 66318975) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 4-methoxy-6-(2-pyrrolidin-2-ylpiperidin-1-yl)pyrimidine.

Molecular Properties

Compound Name4-methoxy-6-(2-pyrrolidin-2-ylpiperidin-1-yl)pyrimidine
PubChem CID66318975
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name4-methoxy-6-(2-pyrrolidin-2-ylpiperidin-1-yl)pyrimidine
SMILESCOc1cc(N2CCCCC2C2CCCN2)ncn1
InChIInChI=1S/C14H22N4O/c1-19-14-9-13(16-10-17-14)18-8-3-2-6-12(18)11-5-4-7-15-11/h9-12,15H,2-8H2,1H3
InChIKeyPMZMTIRIJKQJES-UHFFFAOYSA-N
XLogP1.60
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-6-(2-pyrrolidin-2-ylpiperidin-1-yl)pyridine
CID 55214728
1-(6-methoxypyrimidin-4-yl)azocane-2-carboxylic acid
CID 114239764
2-(2-pyrrolidin-2-ylpiperidin-1-yl)quinoxaline
CID 63254716
5-methyl-4-nitro-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)pyridine
CID 83259903
[1-(6-methoxypyrimidin-4-yl)-3-methylpiperidin-2-yl]methanamine
CID 66317614
methyl 2-[1-(6-methoxypyrimidin-4-yl)piperidin-2-yl]acetate
CID 66318081
4-methoxy-6-piperidin-2-ylpyrimidine
CID 82656666
4-(2-pyrrolidin-2-ylpiperidin-1-yl)thieno[2,3-d]pyrimidine
CID 63254204
6-methyl-2-(2-pyrrolidin-2-ylpiperidin-1-yl)pyrimidine-4-carbonitrile
CID 107552498
4-chloro-6-(2-methylpiperidin-1-yl)pyrimidine
CID 53410093
(4aS,8aR)-4-(4-methoxyphenyl)-2,3,4a,5,6,7,8,8a-octahydro-1H-quinoxaline
CID 124675892
6-methoxy-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine;hydrochloride
CID 66569768

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-6-(2-pyrrolidin-2-ylpiperidin-1-yl)pyrimidine?
The IUPAC name of 4-methoxy-6-(2-pyrrolidin-2-ylpiperidin-1-yl)pyrimidine (CID 66318975) is 4-methoxy-6-(2-pyrrolidin-2-ylpiperidin-1-yl)pyrimidine.
What is the SMILES notation for 4-methoxy-6-(2-pyrrolidin-2-ylpiperidin-1-yl)pyrimidine?
The canonical SMILES for 4-methoxy-6-(2-pyrrolidin-2-ylpiperidin-1-yl)pyrimidine is COc1cc(N2CCCCC2C2CCCN2)ncn1.
What is the InChIKey of 4-methoxy-6-(2-pyrrolidin-2-ylpiperidin-1-yl)pyrimidine?
The InChIKey is PMZMTIRIJKQJES-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-19-14-9-13(16-10-17-14)18-8-3-2-6-12(18)11-5-4-7-15-11/h9-12,15H,2-8H2,1H3.
What are the key properties of 4-methoxy-6-(2-pyrrolidin-2-ylpiperidin-1-yl)pyrimidine?
4-methoxy-6-(2-pyrrolidin-2-ylpiperidin-1-yl)pyrimidine has a molecular weight of 262.36 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-6-(2-pyrrolidin-2-ylpiperidin-1-yl)pyrimidine is sourced from PubChem (CID 66318975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).