2-methyl-5-[[(3S)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]methyl]pyridine

C15H20N4 — CID 125015783

IUPAC2-methyl-5-[[(3S)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]methyl]pyridine
SMILESCc1ccc(CN2CC[C@H](c3ncc(C)[nH]3)C2)cn1
InChIInChI=1S/C15H20N4/c1-11-3-4-13(8-16-11)9-19-6-5-14(10-19)15-17-7-12(2)18-15/h3-4,7-8,14H,5-6,9-10H2,1-2H3,(H,17,18)/t14-/m0/s1
InChIKeyWWCWWMDUJRFCHV-AWEZNQCLSA-N
MW256.35 g/mol
LogP2.41
Rot. Bonds3

About 2-methyl-5-[[(3S)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]methyl]pyridine

2-methyl-5-[[(3S)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]methyl]pyridine (PubChem CID 125015783) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-methyl-5-[[(3S)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]methyl]pyridine.

Molecular Properties

Compound Name2-methyl-5-[[(3S)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]methyl]pyridine
PubChem CID125015783
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name2-methyl-5-[[(3S)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]methyl]pyridine
SMILESCc1ccc(CN2CC[C@H](c3ncc(C)[nH]3)C2)cn1
InChIInChI=1S/C15H20N4/c1-11-3-4-13(8-16-11)9-19-6-5-14(10-19)15-17-7-12(2)18-15/h3-4,7-8,14H,5-6,9-10H2,1-2H3,(H,17,18)/t14-/m0/s1
InChIKeyWWCWWMDUJRFCHV-AWEZNQCLSA-N
XLogP2.41
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-5-[[(3R)-3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]methyl]pyrimidine
CID 125022368
1-ethyl-4-[[(3R)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]methyl]pyrazole
CID 124978097
5-methyl-2-[1-(3-phenylpropyl)pyrrolidin-3-yl]-1H-imidazole
CID 110104616
1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(5-methyl-1H-imidazol-2-yl)piperidine
CID 110104068
2-[(3R)-1-(2-methoxyethyl)pyrrolidin-3-yl]-5-methyl-1H-imidazole
CID 125006103
N-ethyl-1-[(6-methyl-3-pyridinyl)methyl]pyrrolidin-3-amine
CID 62994803
1-[(6-methyl-3-pyridinyl)methyl]pyrrolidine-3-carboxylic acid
CID 104823895
(3R)-1-[(1-ethylpyrazol-4-yl)methyl]-3-(5-methyl-1H-imidazol-2-yl)piperidine
CID 124970369
1-[(3,5-dimethoxyphenyl)methyl]-3-(5-methyl-1H-imidazol-2-yl)piperidine
CID 110104080
4-[[(3S)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]methyl]-1H-indole
CID 124940343
1-ethyl-4-[(3S)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]piperidine
CID 125019244
2-[(3R)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]pyrimidine
CID 125013337

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-[[(3S)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]methyl]pyridine?
The IUPAC name of 2-methyl-5-[[(3S)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]methyl]pyridine (CID 125015783) is 2-methyl-5-[[(3S)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]methyl]pyridine.
What is the SMILES notation for 2-methyl-5-[[(3S)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]methyl]pyridine?
The canonical SMILES for 2-methyl-5-[[(3S)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]methyl]pyridine is Cc1ccc(CN2CC[C@H](c3ncc(C)[nH]3)C2)cn1.
What is the InChIKey of 2-methyl-5-[[(3S)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]methyl]pyridine?
The InChIKey is WWCWWMDUJRFCHV-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H20N4/c1-11-3-4-13(8-16-11)9-19-6-5-14(10-19)15-17-7-12(2)18-15/h3-4,7-8,14H,5-6,9-10H2,1-2H3,(H,17,18)/t14-/m0/s1.
What are the key properties of 2-methyl-5-[[(3S)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]methyl]pyridine?
2-methyl-5-[[(3S)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]methyl]pyridine has a molecular weight of 256.35 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-[[(3S)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]methyl]pyridine is sourced from PubChem (CID 125015783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).