2-methyl-5-[[(2R)-2-pyrimidin-4-ylpiperidin-1-yl]methyl]pyrimidine

C15H19N5 — CID 125026753

IUPAC2-methyl-5-[[(2R)-2-pyrimidin-4-ylpiperidin-1-yl]methyl]pyrimidine
SMILESCc1ncc(CN2CCCC[C@@H]2c2ccncn2)cn1
InChIInChI=1S/C15H19N5/c1-12-17-8-13(9-18-12)10-20-7-3-2-4-15(20)14-5-6-16-11-19-14/h5-6,8-9,11,15H,2-4,7,10H2,1H3/t15-/m1/s1
InChIKeyZVXYHUUMVIMIJB-OAHLLOKOSA-N
MW269.35 g/mol
LogP2.30
Rot. Bonds3

About 2-methyl-5-[[(2R)-2-pyrimidin-4-ylpiperidin-1-yl]methyl]pyrimidine

2-methyl-5-[[(2R)-2-pyrimidin-4-ylpiperidin-1-yl]methyl]pyrimidine (PubChem CID 125026753) has the molecular formula C15H19N5 and a molecular weight of 269.35 g/mol. Its IUPAC name is 2-methyl-5-[[(2R)-2-pyrimidin-4-ylpiperidin-1-yl]methyl]pyrimidine.

Molecular Properties

Compound Name2-methyl-5-[[(2R)-2-pyrimidin-4-ylpiperidin-1-yl]methyl]pyrimidine
PubChem CID125026753
Molecular FormulaC15H19N5
Molecular Weight269.35 g/mol
Exact Mass269.16
IUPAC Name2-methyl-5-[[(2R)-2-pyrimidin-4-ylpiperidin-1-yl]methyl]pyrimidine
SMILESCc1ncc(CN2CCCC[C@@H]2c2ccncn2)cn1
InChIInChI=1S/C15H19N5/c1-12-17-8-13(9-18-12)10-20-7-3-2-4-15(20)14-5-6-16-11-19-14/h5-6,8-9,11,15H,2-4,7,10H2,1H3/t15-/m1/s1
InChIKeyZVXYHUUMVIMIJB-OAHLLOKOSA-N
XLogP2.30
TPSA54.80 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-5-[[(2S)-2-pyrimidin-4-ylpiperidin-1-yl]methyl]pyrimidine
CID 95846033
4-(1-benzylpyrrolidin-2-yl)pyrimidine
CID 175656203
4-[(2R)-1-[(1-propylpyrazol-4-yl)methyl]piperidin-2-yl]pyrimidine
CID 125016297
4-[1-[(3-methylimidazol-4-yl)methyl]piperidin-2-yl]pyrimidine
CID 110271171
4-[1-[(3-chlorophenyl)methyl]piperidin-2-yl]pyrimidine
CID 110270807
4-[(2S)-1-[(3-chlorophenyl)methyl]piperidin-2-yl]pyrimidine
CID 95845165
4-[(2S)-1-[(3-methylthiophen-2-yl)methyl]piperidin-2-yl]pyrimidine
CID 124971540
6-[(2-pyrimidin-4-ylpiperidin-1-yl)methyl]-1H-indole
CID 127244845
4-[1-(furan-2-ylmethyl)piperidin-2-yl]pyrimidine
CID 127244796
4-[(2S)-1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyrimidine
CID 95817567
4-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyrimidine
CID 110254306
4-[(2S)-1-[(2,5-difluorophenyl)methyl]piperidin-2-yl]pyrimidine
CID 124953340

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-[[(2R)-2-pyrimidin-4-ylpiperidin-1-yl]methyl]pyrimidine?
The IUPAC name of 2-methyl-5-[[(2R)-2-pyrimidin-4-ylpiperidin-1-yl]methyl]pyrimidine (CID 125026753) is 2-methyl-5-[[(2R)-2-pyrimidin-4-ylpiperidin-1-yl]methyl]pyrimidine.
What is the SMILES notation for 2-methyl-5-[[(2R)-2-pyrimidin-4-ylpiperidin-1-yl]methyl]pyrimidine?
The canonical SMILES for 2-methyl-5-[[(2R)-2-pyrimidin-4-ylpiperidin-1-yl]methyl]pyrimidine is Cc1ncc(CN2CCCC[C@@H]2c2ccncn2)cn1.
What is the InChIKey of 2-methyl-5-[[(2R)-2-pyrimidin-4-ylpiperidin-1-yl]methyl]pyrimidine?
The InChIKey is ZVXYHUUMVIMIJB-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H19N5/c1-12-17-8-13(9-18-12)10-20-7-3-2-4-15(20)14-5-6-16-11-19-14/h5-6,8-9,11,15H,2-4,7,10H2,1H3/t15-/m1/s1.
What are the key properties of 2-methyl-5-[[(2R)-2-pyrimidin-4-ylpiperidin-1-yl]methyl]pyrimidine?
2-methyl-5-[[(2R)-2-pyrimidin-4-ylpiperidin-1-yl]methyl]pyrimidine has a molecular weight of 269.35 g/mol, XLogP of 2.30, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-[[(2R)-2-pyrimidin-4-ylpiperidin-1-yl]methyl]pyrimidine is sourced from PubChem (CID 125026753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).