N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]quinolin-8-amine

C22H20N4 — CID 177207812

IUPACN-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]quinolin-8-amine
SMILESc1cnc2c(Nc3ccc(-c4cn5c(n4)CCCC5)cc3)cccc2c1
InChIInChI=1S/C22H20N4/c1-2-14-26-15-20(25-21(26)8-1)16-9-11-18(12-10-16)24-19-7-3-5-17-6-4-13-23-22(17)19/h3-7,9-13,15,24H,1-2,8,14H2
InChIKeyMKCUMNJDSWCZHB-UHFFFAOYSA-N
MW340.43 g/mol
LogP5.18
Rot. Bonds3

About N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]quinolin-8-amine

N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]quinolin-8-amine (PubChem CID 177207812) has the molecular formula C22H20N4 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]quinolin-8-amine.

Molecular Properties

Compound NameN-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]quinolin-8-amine
PubChem CID177207812
Molecular FormulaC22H20N4
Molecular Weight340.43 g/mol
Exact Mass340.17
IUPAC NameN-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]quinolin-8-amine
SMILESc1cnc2c(Nc3ccc(-c4cn5c(n4)CCCC5)cc3)cccc2c1
InChIInChI=1S/C22H20N4/c1-2-14-26-15-20(25-21(26)8-1)16-9-11-18(12-10-16)24-19-7-3-5-17-6-4-13-23-22(17)19/h3-7,9-13,15,24H,1-2,8,14H2
InChIKeyMKCUMNJDSWCZHB-UHFFFAOYSA-N
XLogP5.18
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.43
LogP ≤ 55.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]quinolin-8-amine?
The IUPAC name of N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]quinolin-8-amine (CID 177207812) is N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]quinolin-8-amine.
What is the SMILES notation for N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]quinolin-8-amine?
The canonical SMILES for N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]quinolin-8-amine is c1cnc2c(Nc3ccc(-c4cn5c(n4)CCCC5)cc3)cccc2c1.
What is the InChIKey of N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]quinolin-8-amine?
The InChIKey is MKCUMNJDSWCZHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4/c1-2-14-26-15-20(25-21(26)8-1)16-9-11-18(12-10-16)24-19-7-3-5-17-6-4-13-23-22(17)19/h3-7,9-13,15,24H,1-2,8,14H2.
What are the key properties of N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]quinolin-8-amine?
N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]quinolin-8-amine has a molecular weight of 340.43 g/mol, XLogP of 5.18, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]quinolin-8-amine is sourced from PubChem (CID 177207812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).