4-[2-[(2R)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]ethyl]pyridine

C17H24N4 — CID 124948812

IUPAC4-[2-[(2R)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]ethyl]pyridine
SMILESCCn1cc(CN2CCC[C@H]2CCc2ccncc2)cn1
InChIInChI=1S/C17H24N4/c1-2-21-14-16(12-19-21)13-20-11-3-4-17(20)6-5-15-7-9-18-10-8-15/h7-10,12,14,17H,2-6,11,13H2,1H3/t17-/m0/s1
InChIKeyCPLXMUGVENFQJD-KRWDZBQOSA-N
MW284.41 g/mol
LogP2.90
Rot. Bonds6

About 4-[2-[(2R)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]ethyl]pyridine

4-[2-[(2R)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]ethyl]pyridine (PubChem CID 124948812) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is 4-[2-[(2R)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]ethyl]pyridine.

Molecular Properties

Compound Name4-[2-[(2R)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]ethyl]pyridine
PubChem CID124948812
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC Name4-[2-[(2R)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]ethyl]pyridine
SMILESCCn1cc(CN2CCC[C@H]2CCc2ccncc2)cn1
InChIInChI=1S/C17H24N4/c1-2-21-14-16(12-19-21)13-20-11-3-4-17(20)6-5-15-7-9-18-10-8-15/h7-10,12,14,17H,2-6,11,13H2,1H3/t17-/m0/s1
InChIKeyCPLXMUGVENFQJD-KRWDZBQOSA-N
XLogP2.90
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[(2S)-2-(2-pyridin-4-ylethyl)pyrrolidin-1-yl]methyl]pyridine
CID 125006197
3-[[(2R)-2-(2-pyridin-4-ylethyl)pyrrolidin-1-yl]methyl]pyridine
CID 125006196
[1-[(1-ethylpyrazol-4-yl)methyl]piperidin-2-yl]methanol
CID 62128080
1-[1-[(1-ethylpyrazol-4-yl)methyl]piperidin-2-yl]-N-methylmethanamine
CID 62126735
(2S)-1-[(1-methylpyrazol-4-yl)methyl]-2-(2-phenylethyl)piperidine
CID 95876965
4-[2-[(2S)-1-[(2-propan-2-ylpyrazol-3-yl)methyl]pyrrolidin-2-yl]ethyl]pyridine
CID 124992720
1-[1-[(1-ethylpyrazol-4-yl)methyl]azepan-2-yl]propan-2-ol
CID 114338918
4-[2-[(2S)-1-(1H-imidazol-2-ylmethyl)pyrrolidin-2-yl]ethyl]pyridine
CID 125016132
4-[2-[(2S)-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]ethyl]pyridine
CID 125024542
4-[2-[(2S)-1-[(1-propan-2-ylimidazol-2-yl)methyl]pyrrolidin-2-yl]ethyl]pyridine
CID 124946744
2-[(2S)-2-(2-pyridin-4-ylethyl)pyrrolidin-1-yl]-1-pyrrolidin-1-ylethanone
CID 124983003
2-[(2R)-2-(2-pyridin-4-ylethyl)pyrrolidin-1-yl]-1-pyrrolidin-1-ylethanone
CID 124983002

Frequently Asked Questions

What is the IUPAC name of 4-[2-[(2R)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]ethyl]pyridine?
The IUPAC name of 4-[2-[(2R)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]ethyl]pyridine (CID 124948812) is 4-[2-[(2R)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]ethyl]pyridine.
What is the SMILES notation for 4-[2-[(2R)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]ethyl]pyridine?
The canonical SMILES for 4-[2-[(2R)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]ethyl]pyridine is CCn1cc(CN2CCC[C@H]2CCc2ccncc2)cn1.
What is the InChIKey of 4-[2-[(2R)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]ethyl]pyridine?
The InChIKey is CPLXMUGVENFQJD-KRWDZBQOSA-N. The full InChI is InChI=1S/C17H24N4/c1-2-21-14-16(12-19-21)13-20-11-3-4-17(20)6-5-15-7-9-18-10-8-15/h7-10,12,14,17H,2-6,11,13H2,1H3/t17-/m0/s1.
What are the key properties of 4-[2-[(2R)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]ethyl]pyridine?
4-[2-[(2R)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]ethyl]pyridine has a molecular weight of 284.41 g/mol, XLogP of 2.90, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(2R)-1-[(1-ethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]ethyl]pyridine is sourced from PubChem (CID 124948812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).