3-methyl-2-[(2S)-6-[1-(3-pyridin-2-ylpropyl)imidazol-2-yl]piperidin-2-yl]pyridine

C22H27N5 — CID 154620137

IUPAC3-methyl-2-[(2S)-6-[1-(3-pyridin-2-ylpropyl)imidazol-2-yl]piperidin-2-yl]pyridine
SMILESCc1cccnc1[C@@H]1CCCC(c2nccn2CCCc2ccccn2)N1
InChIInChI=1S/C22H27N5/c1-17-7-5-13-24-21(17)19-10-4-11-20(26-19)22-25-14-16-27(22)15-6-9-18-8-2-3-12-23-18/h2-3,5,7-8,12-14,16,19-20,26H,4,6,9-11,15H2,1H3/t19-,20?/m0/s1
InChIKeyFKIBIMQAXJSIKF-XJDOXCRVSA-N
MW361.49 g/mol
LogP4.17
Rot. Bonds6

About 3-methyl-2-[(2S)-6-[1-(3-pyridin-2-ylpropyl)imidazol-2-yl]piperidin-2-yl]pyridine

3-methyl-2-[(2S)-6-[1-(3-pyridin-2-ylpropyl)imidazol-2-yl]piperidin-2-yl]pyridine (PubChem CID 154620137) has the molecular formula C22H27N5 and a molecular weight of 361.49 g/mol. Its IUPAC name is 3-methyl-2-[(2S)-6-[1-(3-pyridin-2-ylpropyl)imidazol-2-yl]piperidin-2-yl]pyridine.

Molecular Properties

Compound Name3-methyl-2-[(2S)-6-[1-(3-pyridin-2-ylpropyl)imidazol-2-yl]piperidin-2-yl]pyridine
PubChem CID154620137
Molecular FormulaC22H27N5
Molecular Weight361.49 g/mol
Exact Mass361.23
IUPAC Name3-methyl-2-[(2S)-6-[1-(3-pyridin-2-ylpropyl)imidazol-2-yl]piperidin-2-yl]pyridine
SMILESCc1cccnc1[C@@H]1CCCC(c2nccn2CCCc2ccccn2)N1
InChIInChI=1S/C22H27N5/c1-17-7-5-13-24-21(17)19-10-4-11-20(26-19)22-25-14-16-27(22)15-6-9-18-8-2-3-12-23-18/h2-3,5,7-8,12-14,16,19-20,26H,4,6,9-11,15H2,1H3/t19-,20?/m0/s1
InChIKeyFKIBIMQAXJSIKF-XJDOXCRVSA-N
XLogP4.17
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.49
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-methyl-2-[(2S)-6-[1-(3-pyridin-2-ylpropyl)imidazol-2-yl]piperidin-2-yl]pyridine 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-[(2R,6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-6-(2-pyridin-2-ylethyl)pyridine
CID 162531759
1-methyl-4-[2-[(2R,6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-3-pyridinyl]piperazine
CID 163885662
2-[(5-methyl-3,4-dihydropyridin-6-yl)methyl]-6-[(6S)-6-(3-methyl-2-pyridinyl)piperidin-2-yl]pyridine
CID 162531886
N-cyclopentyl-1-(2-pyridin-2-ylethyl)imidazol-2-amine
CID 106554398
2-(3-methyl-2-pyridinyl)azepane
CID 81148387
2-[(3S)-3-(1-butylimidazol-2-yl)piperidin-1-yl]-3-methylpyridine
CID 97192145
3-methyl-2-[(2S)-1-methyl-6-[1-(1-methylpiperidin-4-yl)imidazol-2-yl]piperidin-2-yl]pyridine
CID 145424448
2-methylpyridine;2-(12-pyridin-2-yldodecyl)pyridine
CID 158040240
1-(2-pyridin-2-ylethyl)pyrimidin-2-one
CID 116618349
1-(2-pyridin-2-ylethyl)imidazole-2-carbaldehyde
CID 62221205
2-[[2-[(3S)-piperidin-3-yl]imidazol-1-yl]methyl]pyridine
CID 97357420
1-[(3R)-3-(1-butylimidazol-2-yl)piperidin-1-yl]-3-(2-methylphenyl)propan-1-one
CID 97200732

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-[(2S)-6-[1-(3-pyridin-2-ylpropyl)imidazol-2-yl]piperidin-2-yl]pyridine?
The IUPAC name of 3-methyl-2-[(2S)-6-[1-(3-pyridin-2-ylpropyl)imidazol-2-yl]piperidin-2-yl]pyridine (CID 154620137) is 3-methyl-2-[(2S)-6-[1-(3-pyridin-2-ylpropyl)imidazol-2-yl]piperidin-2-yl]pyridine.
What is the SMILES notation for 3-methyl-2-[(2S)-6-[1-(3-pyridin-2-ylpropyl)imidazol-2-yl]piperidin-2-yl]pyridine?
The canonical SMILES for 3-methyl-2-[(2S)-6-[1-(3-pyridin-2-ylpropyl)imidazol-2-yl]piperidin-2-yl]pyridine is Cc1cccnc1[C@@H]1CCCC(c2nccn2CCCc2ccccn2)N1.
What is the InChIKey of 3-methyl-2-[(2S)-6-[1-(3-pyridin-2-ylpropyl)imidazol-2-yl]piperidin-2-yl]pyridine?
The InChIKey is FKIBIMQAXJSIKF-XJDOXCRVSA-N. The full InChI is InChI=1S/C22H27N5/c1-17-7-5-13-24-21(17)19-10-4-11-20(26-19)22-25-14-16-27(22)15-6-9-18-8-2-3-12-23-18/h2-3,5,7-8,12-14,16,19-20,26H,4,6,9-11,15H2,1H3/t19-,20?/m0/s1.
What are the key properties of 3-methyl-2-[(2S)-6-[1-(3-pyridin-2-ylpropyl)imidazol-2-yl]piperidin-2-yl]pyridine?
3-methyl-2-[(2S)-6-[1-(3-pyridin-2-ylpropyl)imidazol-2-yl]piperidin-2-yl]pyridine has a molecular weight of 361.49 g/mol, XLogP of 4.17, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-[(2S)-6-[1-(3-pyridin-2-ylpropyl)imidazol-2-yl]piperidin-2-yl]pyridine is sourced from PubChem (CID 154620137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).