6-[[4-[2-methyl-6-[(2R)-pyrrolidin-2-yl]-4-pyridinyl]piperazin-1-yl]methyl]quinoline

C24H29N5 — CID 92619694

IUPAC6-[[4-[2-methyl-6-[(2R)-pyrrolidin-2-yl]-4-pyridinyl]piperazin-1-yl]methyl]quinoline
SMILESCc1cc(N2CCN(Cc3ccc4ncccc4c3)CC2)cc([C@H]2CCCN2)n1
InChIInChI=1S/C24H29N5/c1-18-14-21(16-24(27-18)23-5-3-9-26-23)29-12-10-28(11-13-29)17-19-6-7-22-20(15-19)4-2-8-25-22/h2,4,6-8,14-16,23,26H,3,5,9-13,17H2,1H3/t23-/m1/s1
InChIKeyPRJYUDMVAQQUMQ-HSZRJFAPSA-N
MW387.53 g/mol
LogP3.68
Rot. Bonds4

About 6-[[4-[2-methyl-6-[(2R)-pyrrolidin-2-yl]-4-pyridinyl]piperazin-1-yl]methyl]quinoline

6-[[4-[2-methyl-6-[(2R)-pyrrolidin-2-yl]-4-pyridinyl]piperazin-1-yl]methyl]quinoline (PubChem CID 92619694) has the molecular formula C24H29N5 and a molecular weight of 387.53 g/mol. Its IUPAC name is 6-[[4-[2-methyl-6-[(2R)-pyrrolidin-2-yl]-4-pyridinyl]piperazin-1-yl]methyl]quinoline.

Molecular Properties

Compound Name6-[[4-[2-methyl-6-[(2R)-pyrrolidin-2-yl]-4-pyridinyl]piperazin-1-yl]methyl]quinoline
PubChem CID92619694
Molecular FormulaC24H29N5
Molecular Weight387.53 g/mol
Exact Mass387.24
IUPAC Name6-[[4-[2-methyl-6-[(2R)-pyrrolidin-2-yl]-4-pyridinyl]piperazin-1-yl]methyl]quinoline
SMILESCc1cc(N2CCN(Cc3ccc4ncccc4c3)CC2)cc([C@H]2CCCN2)n1
InChIInChI=1S/C24H29N5/c1-18-14-21(16-24(27-18)23-5-3-9-26-23)29-12-10-28(11-13-29)17-19-6-7-22-20(15-19)4-2-8-25-22/h2,4,6-8,14-16,23,26H,3,5,9-13,17H2,1H3/t23-/m1/s1
InChIKeyPRJYUDMVAQQUMQ-HSZRJFAPSA-N
XLogP3.68
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.53
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-[[4-[2-methyl-6-[(2R)-pyrrolidin-2-yl]-4-pyridinyl]piperazin-1-yl]methyl]quinoline with MolForge

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Related Compounds

N,N-dimethyl-3-[[4-(2-methyl-6-pyrrolidin-2-yl-4-pyridinyl)piperazin-1-yl]methyl]pyridin-2-amine
CID 110260485
1-(2-methylpropyl)-4-[2-methyl-6-[(2S)-pyrrolidin-2-yl]-4-pyridinyl]piperazine
CID 92619861
1-[(5-tert-butyl-1H-pyrazol-4-yl)methyl]-4-[2-methyl-6-[(2R)-pyrrolidin-2-yl]-4-pyridinyl]piperazine
CID 92619631
6-[[(3S)-3-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-1-yl]methyl]quinoline
CID 95829818
6-(piperazin-1-ylmethyl)quinoline;dihydrochloride
CID 82025620
6-[[(3S)-3-methylpiperazin-1-yl]methyl]quinoline
CID 103885682
1-(benzenesulfonyl)-4-[2-methyl-6-[(2S)-pyrrolidin-2-yl]-4-pyridinyl]piperazine
CID 92619879
N,N-diethyl-4-[2-methyl-6-[(2S)-pyrrolidin-2-yl]-4-pyridinyl]piperazine-1-sulfonamide
CID 92619675
1-(2-methyl-6-pyrrolidin-2-yl-4-pyridinyl)-4-pyrrolidin-1-ylsulfonylpiperazine
CID 110260458
6-[(3-propylpiperazin-1-yl)methyl]quinoline
CID 64833799
6-[[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]methyl]quinoline
CID 124568885
(3S)-1-(quinolin-6-ylmethyl)pyrrolidin-3-ol
CID 79031483

Frequently Asked Questions

What is the IUPAC name of 6-[[4-[2-methyl-6-[(2R)-pyrrolidin-2-yl]-4-pyridinyl]piperazin-1-yl]methyl]quinoline?
The IUPAC name of 6-[[4-[2-methyl-6-[(2R)-pyrrolidin-2-yl]-4-pyridinyl]piperazin-1-yl]methyl]quinoline (CID 92619694) is 6-[[4-[2-methyl-6-[(2R)-pyrrolidin-2-yl]-4-pyridinyl]piperazin-1-yl]methyl]quinoline.
What is the SMILES notation for 6-[[4-[2-methyl-6-[(2R)-pyrrolidin-2-yl]-4-pyridinyl]piperazin-1-yl]methyl]quinoline?
The canonical SMILES for 6-[[4-[2-methyl-6-[(2R)-pyrrolidin-2-yl]-4-pyridinyl]piperazin-1-yl]methyl]quinoline is Cc1cc(N2CCN(Cc3ccc4ncccc4c3)CC2)cc([C@H]2CCCN2)n1.
What is the InChIKey of 6-[[4-[2-methyl-6-[(2R)-pyrrolidin-2-yl]-4-pyridinyl]piperazin-1-yl]methyl]quinoline?
The InChIKey is PRJYUDMVAQQUMQ-HSZRJFAPSA-N. The full InChI is InChI=1S/C24H29N5/c1-18-14-21(16-24(27-18)23-5-3-9-26-23)29-12-10-28(11-13-29)17-19-6-7-22-20(15-19)4-2-8-25-22/h2,4,6-8,14-16,23,26H,3,5,9-13,17H2,1H3/t23-/m1/s1.
What are the key properties of 6-[[4-[2-methyl-6-[(2R)-pyrrolidin-2-yl]-4-pyridinyl]piperazin-1-yl]methyl]quinoline?
6-[[4-[2-methyl-6-[(2R)-pyrrolidin-2-yl]-4-pyridinyl]piperazin-1-yl]methyl]quinoline has a molecular weight of 387.53 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[4-[2-methyl-6-[(2R)-pyrrolidin-2-yl]-4-pyridinyl]piperazin-1-yl]methyl]quinoline is sourced from PubChem (CID 92619694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).