5-[[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]methyl]-2-pyrrolidin-1-ylpyridine

C19H27N5 — CID 75496992

IUPAC5-[[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]methyl]-2-pyrrolidin-1-ylpyridine
SMILESCn1cc(CC2CCN(Cc3ccc(N4CCCC4)nc3)C2)cn1
InChIInChI=1S/C19H27N5/c1-22-13-18(12-21-22)10-16-6-9-23(14-16)15-17-4-5-19(20-11-17)24-7-2-3-8-24/h4-5,11-13,16H,2-3,6-10,14-15H2,1H3
InChIKeyJHZXDMAAAPDUEI-UHFFFAOYSA-N
MW325.46 g/mol
LogP2.48
Rot. Bonds5

About 5-[[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]methyl]-2-pyrrolidin-1-ylpyridine

5-[[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]methyl]-2-pyrrolidin-1-ylpyridine (PubChem CID 75496992) has the molecular formula C19H27N5 and a molecular weight of 325.46 g/mol. Its IUPAC name is 5-[[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]methyl]-2-pyrrolidin-1-ylpyridine.

Molecular Properties

Compound Name5-[[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]methyl]-2-pyrrolidin-1-ylpyridine
PubChem CID75496992
Molecular FormulaC19H27N5
Molecular Weight325.46 g/mol
Exact Mass325.23
IUPAC Name5-[[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]methyl]-2-pyrrolidin-1-ylpyridine
SMILESCn1cc(CC2CCN(Cc3ccc(N4CCCC4)nc3)C2)cn1
InChIInChI=1S/C19H27N5/c1-22-13-18(12-21-22)10-16-6-9-23(14-16)15-17-4-5-19(20-11-17)24-7-2-3-8-24/h4-5,11-13,16H,2-3,6-10,14-15H2,1H3
InChIKeyJHZXDMAAAPDUEI-UHFFFAOYSA-N
XLogP2.48
TPSA37.19 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.46
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 5-[[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]methyl]-2-pyrrolidin-1-ylpyridine with MolForge

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Related Compounds

2-[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]-5-piperidin-1-ylsulfonylpyridine
CID 133341841
2-[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]-5-nitropyridine
CID 133341964
3,3-dimethyl-1-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]piperidin-4-amine;hydrochloride
CID 120781479
5-[[(3R)-1-[(1-methylpyrazol-4-yl)methyl]piperidin-3-yl]methyl]-1H-pyrrolo[2,3-b]pyridine
CID 124964578
1-methyl-4-[(1-methylpyrazol-4-yl)methyl]piperidine
CID 121407190
5-[(4-phenoxypiperidin-1-yl)methyl]-2-pyrrolidin-1-ylpyridine
CID 138042107
4-methyl-2-[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]pyrimidine
CID 133342054
3-(4-fluorophenyl)-6-[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]pyridazine
CID 133341779
(2R)-2-[[(3R)-3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]methyl]pentanedinitrile
CID 96524376
(2S)-2-[[(3R)-3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]methyl]pentanedinitrile
CID 100860920
1-ethyl-4-[5-[(4-ethylpiperazin-1-yl)methyl]-2-pyridinyl]piperazine
CID 155403164
(2R)-4-[(1-methylpyrazol-4-yl)methyl]-2-(2-methyl-6-pyrrolidin-1-ylpyrimidin-4-yl)morpholine
CID 95847566

Frequently Asked Questions

What is the IUPAC name of 5-[[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]methyl]-2-pyrrolidin-1-ylpyridine?
The IUPAC name of 5-[[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]methyl]-2-pyrrolidin-1-ylpyridine (CID 75496992) is 5-[[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]methyl]-2-pyrrolidin-1-ylpyridine.
What is the SMILES notation for 5-[[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]methyl]-2-pyrrolidin-1-ylpyridine?
The canonical SMILES for 5-[[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]methyl]-2-pyrrolidin-1-ylpyridine is Cn1cc(CC2CCN(Cc3ccc(N4CCCC4)nc3)C2)cn1.
What is the InChIKey of 5-[[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]methyl]-2-pyrrolidin-1-ylpyridine?
The InChIKey is JHZXDMAAAPDUEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5/c1-22-13-18(12-21-22)10-16-6-9-23(14-16)15-17-4-5-19(20-11-17)24-7-2-3-8-24/h4-5,11-13,16H,2-3,6-10,14-15H2,1H3.
What are the key properties of 5-[[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]methyl]-2-pyrrolidin-1-ylpyridine?
5-[[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]methyl]-2-pyrrolidin-1-ylpyridine has a molecular weight of 325.46 g/mol, XLogP of 2.48, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[3-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-1-yl]methyl]-2-pyrrolidin-1-ylpyridine is sourced from PubChem (CID 75496992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).