6-(4-cyclopentylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine

C16H22N4 — CID 141174943

IUPAC6-(4-cyclopentylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine
SMILESc1cc2ccc(N3CCN(C4CCCC4)CC3)nc2[nH]1
InChIInChI=1S/C16H22N4/c1-2-4-14(3-1)19-9-11-20(12-10-19)15-6-5-13-7-8-17-16(13)18-15/h5-8,14H,1-4,9-12H2,(H,17,18)
InChIKeyCMLOQUUCCRLPCW-UHFFFAOYSA-N
MW270.38 g/mol
LogP2.63
Rot. Bonds2

About 6-(4-cyclopentylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine

6-(4-cyclopentylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine (PubChem CID 141174943) has the molecular formula C16H22N4 and a molecular weight of 270.38 g/mol. Its IUPAC name is 6-(4-cyclopentylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name6-(4-cyclopentylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine
PubChem CID141174943
Molecular FormulaC16H22N4
Molecular Weight270.38 g/mol
Exact Mass270.18
IUPAC Name6-(4-cyclopentylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine
SMILESc1cc2ccc(N3CCN(C4CCCC4)CC3)nc2[nH]1
InChIInChI=1S/C16H22N4/c1-2-4-14(3-1)19-9-11-20(12-10-19)15-6-5-13-7-8-17-16(13)18-15/h5-8,14H,1-4,9-12H2,(H,17,18)
InChIKeyCMLOQUUCCRLPCW-UHFFFAOYSA-N
XLogP2.63
TPSA35.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[4-(thian-4-yl)piperazin-1-yl]-1H-pyrrolo[2,3-b]pyridine
CID 56913520
6-piperazin-1-yl-1H-pyrrolo[2,3-b]pyridine
CID 68568912
2-(4-cyclopentyl-1,4-diazepan-1-yl)quinoline
CID 70742061
[6-(4-cyclopentylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-(3-hydroxypyrrolidin-1-yl)methanone
CID 23627777
(2S,6R)-2,6-dimethyl-4-(1H-pyrrolo[2,3-b]pyridin-6-yl)morpholine
CID 56888603
N,N-dimethyl-4-(1H-pyrrolo[2,3-b]pyridin-6-yl)piperazine-1-sulfonamide
CID 56916773
4-methyl-6-[4-(1H-pyrrolo[2,3-b]pyridin-6-yl)piperazin-1-yl]pyrimidin-2-amine
CID 56914697
6-[4-(pyridin-4-ylmethyl)-1,4-diazepan-1-yl]-1H-pyrrolo[2,3-b]pyridine
CID 56886048
4-(4-cyclopentylpiperazin-1-yl)-2-methylpyrimidine
CID 121184719
3-[1-(1H-pyrrolo[2,3-b]pyridin-6-yl)piperidin-3-yl]-[1,2,4]triazolo[4,3-a]pyridine
CID 56899043
6-(4-cyclopentylpiperazin-1-yl)-2-methoxypyridin-3-amine
CID 62368609
6-[(3S)-3-(2,3-dimethoxyphenyl)pyrrolidin-1-yl]-1H-pyrrolo[2,3-b]pyridine
CID 95889188

Frequently Asked Questions

What is the IUPAC name of 6-(4-cyclopentylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 6-(4-cyclopentylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine (CID 141174943) is 6-(4-cyclopentylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 6-(4-cyclopentylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 6-(4-cyclopentylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine is c1cc2ccc(N3CCN(C4CCCC4)CC3)nc2[nH]1.
What is the InChIKey of 6-(4-cyclopentylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is CMLOQUUCCRLPCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4/c1-2-4-14(3-1)19-9-11-20(12-10-19)15-6-5-13-7-8-17-16(13)18-15/h5-8,14H,1-4,9-12H2,(H,17,18).
What are the key properties of 6-(4-cyclopentylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine?
6-(4-cyclopentylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 270.38 g/mol, XLogP of 2.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-cyclopentylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 141174943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).