4-(2,3-dimethylimidazol-4-yl)-6-methyl-2-[(3R)-1-methylpiperidin-3-yl]pyrimidine

C16H23N5 — CID 124997329

IUPAC4-(2,3-dimethylimidazol-4-yl)-6-methyl-2-[(3R)-1-methylpiperidin-3-yl]pyrimidine
SMILESCc1cc(-c2cnc(C)n2C)nc([C@@H]2CCCN(C)C2)n1
InChIInChI=1S/C16H23N5/c1-11-8-14(15-9-17-12(2)21(15)4)19-16(18-11)13-6-5-7-20(3)10-13/h8-9,13H,5-7,10H2,1-4H3/t13-/m1/s1
InChIKeyQZLCODUGTMTZHK-CYBMUJFWSA-N
MW285.39 g/mol
LogP2.30
Rot. Bonds2

About 4-(2,3-dimethylimidazol-4-yl)-6-methyl-2-[(3R)-1-methylpiperidin-3-yl]pyrimidine

4-(2,3-dimethylimidazol-4-yl)-6-methyl-2-[(3R)-1-methylpiperidin-3-yl]pyrimidine (PubChem CID 124997329) has the molecular formula C16H23N5 and a molecular weight of 285.39 g/mol. Its IUPAC name is 4-(2,3-dimethylimidazol-4-yl)-6-methyl-2-[(3R)-1-methylpiperidin-3-yl]pyrimidine.

Molecular Properties

Compound Name4-(2,3-dimethylimidazol-4-yl)-6-methyl-2-[(3R)-1-methylpiperidin-3-yl]pyrimidine
PubChem CID124997329
Molecular FormulaC16H23N5
Molecular Weight285.39 g/mol
Exact Mass285.20
IUPAC Name4-(2,3-dimethylimidazol-4-yl)-6-methyl-2-[(3R)-1-methylpiperidin-3-yl]pyrimidine
SMILESCc1cc(-c2cnc(C)n2C)nc([C@@H]2CCCN(C)C2)n1
InChIInChI=1S/C16H23N5/c1-11-8-14(15-9-17-12(2)21(15)4)19-16(18-11)13-6-5-7-20(3)10-13/h8-9,13H,5-7,10H2,1-4H3/t13-/m1/s1
InChIKeyQZLCODUGTMTZHK-CYBMUJFWSA-N
XLogP2.30
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[4-[4-(2,3-dimethylimidazol-4-yl)-6-methylpyrimidin-2-yl]piperidin-1-yl]ethanone
CID 110130977
4-(2,3-dimethylimidazol-4-yl)-6-methyl-2-[(2S)-1-methylpiperidin-2-yl]pyrimidine
CID 124976709
4-methyl-2-[6-methyl-2-(1-methylpiperidin-3-yl)pyrimidin-4-yl]-1,3-thiazole
CID 110100437
[4-[6-methyl-2-(1-methylpiperidin-3-yl)pyrimidin-4-yl]phenyl]methanol
CID 110257482
4-methyl-2-(1-methylpiperidin-3-yl)pyrimidine
CID 122609712
6-methyl-2-[(3R)-1-methylpiperidin-3-yl]-N-pyrazin-2-ylpyrimidin-4-amine
CID 95820185
(2R)-2-[4-(2,3-dimethylimidazol-4-yl)-6-methylpyrimidin-2-yl]-N,N-dimethylpiperidine-1-sulfonamide
CID 124948683
4-methyl-6-(1-methylpiperidin-3-yl)-2-pyrrolidin-3-ylpyrimidine
CID 116893403
4,5-dimethyl-N-[6-methyl-2-(1-methylpiperidin-3-yl)pyrimidin-4-yl]-1,3-thiazol-2-amine
CID 110095386
2-(2,3-dimethylimidazol-4-yl)-6-[(3R)-1-propan-2-ylpiperidin-3-yl]pyrazine
CID 125005520
6-methyl-2-(1-methylpiperidin-3-yl)-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 110257270
2-[(3S)-1-(cyclopropylmethyl)piperidin-3-yl]-4,6-dimethylpyrimidine
CID 95821591

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dimethylimidazol-4-yl)-6-methyl-2-[(3R)-1-methylpiperidin-3-yl]pyrimidine?
The IUPAC name of 4-(2,3-dimethylimidazol-4-yl)-6-methyl-2-[(3R)-1-methylpiperidin-3-yl]pyrimidine (CID 124997329) is 4-(2,3-dimethylimidazol-4-yl)-6-methyl-2-[(3R)-1-methylpiperidin-3-yl]pyrimidine.
What is the SMILES notation for 4-(2,3-dimethylimidazol-4-yl)-6-methyl-2-[(3R)-1-methylpiperidin-3-yl]pyrimidine?
The canonical SMILES for 4-(2,3-dimethylimidazol-4-yl)-6-methyl-2-[(3R)-1-methylpiperidin-3-yl]pyrimidine is Cc1cc(-c2cnc(C)n2C)nc([C@@H]2CCCN(C)C2)n1.
What is the InChIKey of 4-(2,3-dimethylimidazol-4-yl)-6-methyl-2-[(3R)-1-methylpiperidin-3-yl]pyrimidine?
The InChIKey is QZLCODUGTMTZHK-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H23N5/c1-11-8-14(15-9-17-12(2)21(15)4)19-16(18-11)13-6-5-7-20(3)10-13/h8-9,13H,5-7,10H2,1-4H3/t13-/m1/s1.
What are the key properties of 4-(2,3-dimethylimidazol-4-yl)-6-methyl-2-[(3R)-1-methylpiperidin-3-yl]pyrimidine?
4-(2,3-dimethylimidazol-4-yl)-6-methyl-2-[(3R)-1-methylpiperidin-3-yl]pyrimidine has a molecular weight of 285.39 g/mol, XLogP of 2.30, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dimethylimidazol-4-yl)-6-methyl-2-[(3R)-1-methylpiperidin-3-yl]pyrimidine is sourced from PubChem (CID 124997329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).