1-[2-(5-pyridin-3-ylbenzimidazol-1-yl)quinolin-8-yl]piperidin-3-amine

C26H24N6 — CID 141038248

IUPAC1-[2-(5-pyridin-3-ylbenzimidazol-1-yl)quinolin-8-yl]piperidin-3-amine
SMILESNC1CCCN(c2cccc3ccc(-n4cnc5cc(-c6cccnc6)ccc54)nc23)C1
InChIInChI=1S/C26H24N6/c27-21-6-3-13-31(16-21)24-7-1-4-18-9-11-25(30-26(18)24)32-17-29-22-14-19(8-10-23(22)32)20-5-2-12-28-15-20/h1-2,4-5,7-12,14-15,17,21H,3,6,13,16,27H2
InChIKeyDBUQVIPSQVPMQI-UHFFFAOYSA-N
MW420.52 g/mol
LogP4.56
Rot. Bonds3

About 1-[2-(5-pyridin-3-ylbenzimidazol-1-yl)quinolin-8-yl]piperidin-3-amine

1-[2-(5-pyridin-3-ylbenzimidazol-1-yl)quinolin-8-yl]piperidin-3-amine (PubChem CID 141038248) has the molecular formula C26H24N6 and a molecular weight of 420.52 g/mol. Its IUPAC name is 1-[2-(5-pyridin-3-ylbenzimidazol-1-yl)quinolin-8-yl]piperidin-3-amine.

Molecular Properties

Compound Name1-[2-(5-pyridin-3-ylbenzimidazol-1-yl)quinolin-8-yl]piperidin-3-amine
PubChem CID141038248
Molecular FormulaC26H24N6
Molecular Weight420.52 g/mol
Exact Mass420.21
IUPAC Name1-[2-(5-pyridin-3-ylbenzimidazol-1-yl)quinolin-8-yl]piperidin-3-amine
SMILESNC1CCCN(c2cccc3ccc(-n4cnc5cc(-c6cccnc6)ccc54)nc23)C1
InChIInChI=1S/C26H24N6/c27-21-6-3-13-31(16-21)24-7-1-4-18-9-11-25(30-26(18)24)32-17-29-22-14-19(8-10-23(22)32)20-5-2-12-28-15-20/h1-2,4-5,7-12,14-15,17,21H,3,6,13,16,27H2
InChIKeyDBUQVIPSQVPMQI-UHFFFAOYSA-N
XLogP4.56
TPSA72.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.52
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-[2-(5-pyridin-3-ylbenzimidazol-1-yl)quinolin-8-yl]piperidin-3-amine with MolForge

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Related Compounds

8-piperidin-1-yl-2-[5-(pyridin-3-ylmethoxy)benzimidazol-1-yl]quinoline
CID 141038235
1-[2-[5-(cyclopropylmethoxy)benzimidazol-1-yl]quinolin-8-yl]piperidin-4-amine
CID 10112406
1-[8-(4-hydroxy-4-methylpiperidin-1-yl)quinolin-2-yl]benzimidazol-5-ol
CID 22227010
2-[5-(2-methoxyethoxy)benzimidazol-1-yl]-8-pyridin-3-ylquinoline
CID 10135365
4-amino-1-[2-(benzimidazol-1-yl)quinolin-8-yl]piperidin-2-one
CID 70928974
1-[2-[5-(pyridin-2-ylmethoxy)benzimidazol-1-yl]quinolin-8-yl]piperidin-4-ol
CID 151210296
N-[1-[2-(5-hydroxybenzimidazol-1-yl)quinolin-8-yl]piperidin-4-yl]-methylboronamidic acid;molecular hydrogen
CID 157233133
1-[2-[5-[(3-methyloxetan-3-yl)methoxy]benzimidazol-1-yl]quinolin-8-yl]piperidin-4-amine;phosphoric acid
CID 73438364
1-(7-pyridin-3-yl-1,2,3,4-tetrahydroacridin-9-yl)pyrrolidin-3-amine
CID 175776998
N-(1-phenylethyl)-4-(5-pyridin-3-ylbenzimidazol-1-yl)pyrimidin-2-amine
CID 18375556
1-(2-methyl-3-pyridinyl)piperidin-3-amine
CID 79043598
1-[5-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrrolidin-3-amine
CID 56769900

Frequently Asked Questions

What is the IUPAC name of 1-[2-(5-pyridin-3-ylbenzimidazol-1-yl)quinolin-8-yl]piperidin-3-amine?
The IUPAC name of 1-[2-(5-pyridin-3-ylbenzimidazol-1-yl)quinolin-8-yl]piperidin-3-amine (CID 141038248) is 1-[2-(5-pyridin-3-ylbenzimidazol-1-yl)quinolin-8-yl]piperidin-3-amine.
What is the SMILES notation for 1-[2-(5-pyridin-3-ylbenzimidazol-1-yl)quinolin-8-yl]piperidin-3-amine?
The canonical SMILES for 1-[2-(5-pyridin-3-ylbenzimidazol-1-yl)quinolin-8-yl]piperidin-3-amine is NC1CCCN(c2cccc3ccc(-n4cnc5cc(-c6cccnc6)ccc54)nc23)C1.
What is the InChIKey of 1-[2-(5-pyridin-3-ylbenzimidazol-1-yl)quinolin-8-yl]piperidin-3-amine?
The InChIKey is DBUQVIPSQVPMQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N6/c27-21-6-3-13-31(16-21)24-7-1-4-18-9-11-25(30-26(18)24)32-17-29-22-14-19(8-10-23(22)32)20-5-2-12-28-15-20/h1-2,4-5,7-12,14-15,17,21H,3,6,13,16,27H2.
What are the key properties of 1-[2-(5-pyridin-3-ylbenzimidazol-1-yl)quinolin-8-yl]piperidin-3-amine?
1-[2-(5-pyridin-3-ylbenzimidazol-1-yl)quinolin-8-yl]piperidin-3-amine has a molecular weight of 420.52 g/mol, XLogP of 4.56, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(5-pyridin-3-ylbenzimidazol-1-yl)quinolin-8-yl]piperidin-3-amine is sourced from PubChem (CID 141038248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).