2-chloro-4-methyl-6-[[(3R)-piperidin-3-yl]methoxy]pyrimidine

C11H16ClN3O — CID 97162859

IUPAC2-chloro-4-methyl-6-[[(3R)-piperidin-3-yl]methoxy]pyrimidine
SMILESCc1cc(OC[C@@H]2CCCNC2)nc(Cl)n1
InChIInChI=1S/C11H16ClN3O/c1-8-5-10(15-11(12)14-8)16-7-9-3-2-4-13-6-9/h5,9,13H,2-4,6-7H2,1H3/t9-/m1/s1
InChIKeyLKUKVYBPTBDVHQ-SECBINFHSA-N
MW241.72 g/mol
LogP1.82
Rot. Bonds3

About 2-chloro-4-methyl-6-[[(3R)-piperidin-3-yl]methoxy]pyrimidine

2-chloro-4-methyl-6-[[(3R)-piperidin-3-yl]methoxy]pyrimidine (PubChem CID 97162859) has the molecular formula C11H16ClN3O and a molecular weight of 241.72 g/mol. Its IUPAC name is 2-chloro-4-methyl-6-[[(3R)-piperidin-3-yl]methoxy]pyrimidine.

Molecular Properties

Compound Name2-chloro-4-methyl-6-[[(3R)-piperidin-3-yl]methoxy]pyrimidine
PubChem CID97162859
Molecular FormulaC11H16ClN3O
Molecular Weight241.72 g/mol
Exact Mass241.10
IUPAC Name2-chloro-4-methyl-6-[[(3R)-piperidin-3-yl]methoxy]pyrimidine
SMILESCc1cc(OC[C@@H]2CCCNC2)nc(Cl)n1
InChIInChI=1S/C11H16ClN3O/c1-8-5-10(15-11(12)14-8)16-7-9-3-2-4-13-6-9/h5,9,13H,2-4,6-7H2,1H3/t9-/m1/s1
InChIKeyLKUKVYBPTBDVHQ-SECBINFHSA-N
XLogP1.82
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.72
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-chloro-4-methyl-6-[[(3R)-piperidin-3-yl]methoxy]pyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,4-dimethyl-6-(pyrrolidin-3-ylmethoxy)pyrimidine
CID 62371609
4-chloro-2-methylsulfanyl-6-(piperidin-3-ylmethoxy)pyrimidine;hydrochloride
CID 71643214
2-chloro-4-methyl-6-[[(2R)-piperidin-2-yl]methoxy]pyrimidine
CID 97162856
2-chloro-6-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine
CID 71638559
2-chloro-4-(2-cyclobutylethoxy)-6-methylpyrimidine
CID 106201441
2-chloro-6-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine;hydrochloride
CID 71638558
3-[(4-chloro-2,6-dimethylphenoxy)methyl]piperidine
CID 15541141
5-methyl-7-(piperidin-3-ylmethoxy)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 62347901
4-ethoxy-6-methyl-N-(piperidin-3-ylmethyl)pyrimidin-2-amine
CID 112634792
4,6-dimethyl-2-[[(3R)-pyrrolidin-3-yl]methoxy]pyrimidine
CID 94408418
2-chloro-4-methyl-6-pyrrolidin-3-yloxypyrimidine;hydrochloride
CID 71638580
(3R)-3-[(3,4-dichlorophenoxy)methyl]piperidine
CID 26190720

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-methyl-6-[[(3R)-piperidin-3-yl]methoxy]pyrimidine?
The IUPAC name of 2-chloro-4-methyl-6-[[(3R)-piperidin-3-yl]methoxy]pyrimidine (CID 97162859) is 2-chloro-4-methyl-6-[[(3R)-piperidin-3-yl]methoxy]pyrimidine.
What is the SMILES notation for 2-chloro-4-methyl-6-[[(3R)-piperidin-3-yl]methoxy]pyrimidine?
The canonical SMILES for 2-chloro-4-methyl-6-[[(3R)-piperidin-3-yl]methoxy]pyrimidine is Cc1cc(OC[C@@H]2CCCNC2)nc(Cl)n1.
What is the InChIKey of 2-chloro-4-methyl-6-[[(3R)-piperidin-3-yl]methoxy]pyrimidine?
The InChIKey is LKUKVYBPTBDVHQ-SECBINFHSA-N. The full InChI is InChI=1S/C11H16ClN3O/c1-8-5-10(15-11(12)14-8)16-7-9-3-2-4-13-6-9/h5,9,13H,2-4,6-7H2,1H3/t9-/m1/s1.
What are the key properties of 2-chloro-4-methyl-6-[[(3R)-piperidin-3-yl]methoxy]pyrimidine?
2-chloro-4-methyl-6-[[(3R)-piperidin-3-yl]methoxy]pyrimidine has a molecular weight of 241.72 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-methyl-6-[[(3R)-piperidin-3-yl]methoxy]pyrimidine is sourced from PubChem (CID 97162859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).