5-methyl-7-[(2R)-1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]imidazo[1,2-a]pyrimidine

C17H22N6 — CID 124952775

IUPAC5-methyl-7-[(2R)-1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]imidazo[1,2-a]pyrimidine
SMILESCc1cc([C@H]2CCCCN2Cc2nccn2C)nc2nccn12
InChIInChI=1S/C17H22N6/c1-13-11-14(20-17-19-7-10-23(13)17)15-5-3-4-8-22(15)12-16-18-6-9-21(16)2/h6-7,9-11,15H,3-5,8,12H2,1-2H3/t15-/m1/s1
InChIKeyDQVZQZMUAAGMIA-OAHLLOKOSA-N
MW310.40 g/mol
LogP2.50
Rot. Bonds3

About 5-methyl-7-[(2R)-1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]imidazo[1,2-a]pyrimidine

5-methyl-7-[(2R)-1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]imidazo[1,2-a]pyrimidine (PubChem CID 124952775) has the molecular formula C17H22N6 and a molecular weight of 310.40 g/mol. Its IUPAC name is 5-methyl-7-[(2R)-1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]imidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name5-methyl-7-[(2R)-1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]imidazo[1,2-a]pyrimidine
PubChem CID124952775
Molecular FormulaC17H22N6
Molecular Weight310.40 g/mol
Exact Mass310.19
IUPAC Name5-methyl-7-[(2R)-1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]imidazo[1,2-a]pyrimidine
SMILESCc1cc([C@H]2CCCCN2Cc2nccn2C)nc2nccn12
InChIInChI=1S/C17H22N6/c1-13-11-14(20-17-19-7-10-23(13)17)15-5-3-4-8-22(15)12-16-18-6-9-21(16)2/h6-7,9-11,15H,3-5,8,12H2,1-2H3/t15-/m1/s1
InChIKeyDQVZQZMUAAGMIA-OAHLLOKOSA-N
XLogP2.50
TPSA51.25 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 5-methyl-7-[(2R)-1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]imidazo[1,2-a]pyrimidine with MolForge

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Related Compounds

2-methyl-6-[1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]-N-pyridin-2-ylpyrimidin-4-amine
CID 110095461
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
7-[1-(benzenesulfonyl)piperidin-2-yl]-5-methylimidazo[1,2-a]pyrimidine
CID 110118141
4,6-dimethyl-N-[3-[(2S)-1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyrazin-2-yl]pyrimidin-2-amine
CID 124996634
1-methyl-2-[[(2S)-2-(1H-pyrazol-5-yl)pyrrolidin-1-yl]methyl]imidazole
CID 95730740
2-[[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]methyl]-1-methylimidazole
CID 51260690
2-methyl-4-[(3R)-4-[(1-methylimidazol-2-yl)methyl]morpholin-3-yl]-1H-pyrimidin-6-one
CID 137145685
N-[4-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine
CID 110097759
N,N,2-trimethyl-6-[(2S)-1-[(1-propylimidazol-2-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-amine
CID 125022398
N-methyl-4-[(2R)-1-[(1-propan-2-ylimidazol-2-yl)methyl]piperidin-2-yl]pyrimidin-2-amine
CID 125015958
2-methoxy-N-[[1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]methyl]ethanamine
CID 63853569

Frequently Asked Questions

What is the IUPAC name of 5-methyl-7-[(2R)-1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]imidazo[1,2-a]pyrimidine?
The IUPAC name of 5-methyl-7-[(2R)-1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]imidazo[1,2-a]pyrimidine (CID 124952775) is 5-methyl-7-[(2R)-1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]imidazo[1,2-a]pyrimidine.
What is the SMILES notation for 5-methyl-7-[(2R)-1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]imidazo[1,2-a]pyrimidine?
The canonical SMILES for 5-methyl-7-[(2R)-1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]imidazo[1,2-a]pyrimidine is Cc1cc([C@H]2CCCCN2Cc2nccn2C)nc2nccn12.
What is the InChIKey of 5-methyl-7-[(2R)-1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]imidazo[1,2-a]pyrimidine?
The InChIKey is DQVZQZMUAAGMIA-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H22N6/c1-13-11-14(20-17-19-7-10-23(13)17)15-5-3-4-8-22(15)12-16-18-6-9-21(16)2/h6-7,9-11,15H,3-5,8,12H2,1-2H3/t15-/m1/s1.
What are the key properties of 5-methyl-7-[(2R)-1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]imidazo[1,2-a]pyrimidine?
5-methyl-7-[(2R)-1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]imidazo[1,2-a]pyrimidine has a molecular weight of 310.40 g/mol, XLogP of 2.50, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-7-[(2R)-1-[(1-methylimidazol-2-yl)methyl]piperidin-2-yl]imidazo[1,2-a]pyrimidine is sourced from PubChem (CID 124952775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).