(8S)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5,6,7,8-tetrahydroquinolin-8-amine

C18H20N4 — CID 59761362

IUPAC(8S)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5,6,7,8-tetrahydroquinolin-8-amine
SMILESCc1cccc2nc(CN[C@H]3CCCc4cccnc43)cn12
InChIInChI=1S/C18H20N4/c1-13-5-2-9-17-21-15(12-22(13)17)11-20-16-8-3-6-14-7-4-10-19-18(14)16/h2,4-5,7,9-10,12,16,20H,3,6,8,11H2,1H3/t16-/m0/s1
InChIKeyDDWOBSWFBAORTG-INIZCTEOSA-N
MW292.39 g/mol
LogP3.20
Rot. Bonds3

About (8S)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5,6,7,8-tetrahydroquinolin-8-amine

(8S)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5,6,7,8-tetrahydroquinolin-8-amine (PubChem CID 59761362) has the molecular formula C18H20N4 and a molecular weight of 292.39 g/mol. Its IUPAC name is (8S)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5,6,7,8-tetrahydroquinolin-8-amine.

Molecular Properties

Compound Name(8S)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5,6,7,8-tetrahydroquinolin-8-amine
PubChem CID59761362
Molecular FormulaC18H20N4
Molecular Weight292.39 g/mol
Exact Mass292.17
IUPAC Name(8S)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5,6,7,8-tetrahydroquinolin-8-amine
SMILESCc1cccc2nc(CN[C@H]3CCCc4cccnc43)cn12
InChIInChI=1S/C18H20N4/c1-13-5-2-9-17-21-15(12-22(13)17)11-20-16-8-3-6-14-7-4-10-19-18(14)16/h2,4-5,7,9-10,12,16,20H,3,6,8,11H2,1H3/t16-/m0/s1
InChIKeyDDWOBSWFBAORTG-INIZCTEOSA-N
XLogP3.20
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.39
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (8S)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5,6,7,8-tetrahydroquinolin-8-amine?
The IUPAC name of (8S)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5,6,7,8-tetrahydroquinolin-8-amine (CID 59761362) is (8S)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5,6,7,8-tetrahydroquinolin-8-amine.
What is the SMILES notation for (8S)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5,6,7,8-tetrahydroquinolin-8-amine?
The canonical SMILES for (8S)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5,6,7,8-tetrahydroquinolin-8-amine is Cc1cccc2nc(CN[C@H]3CCCc4cccnc43)cn12.
What is the InChIKey of (8S)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5,6,7,8-tetrahydroquinolin-8-amine?
The InChIKey is DDWOBSWFBAORTG-INIZCTEOSA-N. The full InChI is InChI=1S/C18H20N4/c1-13-5-2-9-17-21-15(12-22(13)17)11-20-16-8-3-6-14-7-4-10-19-18(14)16/h2,4-5,7,9-10,12,16,20H,3,6,8,11H2,1H3/t16-/m0/s1.
What are the key properties of (8S)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5,6,7,8-tetrahydroquinolin-8-amine?
(8S)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5,6,7,8-tetrahydroquinolin-8-amine has a molecular weight of 292.39 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (8S)-N-[(5-methylimidazo[1,2-a]pyridin-2-yl)methyl]-5,6,7,8-tetrahydroquinolin-8-amine is sourced from PubChem (CID 59761362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).