3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-methylimidazo[1,2-a]pyridin-6-amine

C18H20N4 — CID 82058437

IUPAC3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-methylimidazo[1,2-a]pyridin-6-amine
SMILESCc1nc2ccc(N)cn2c1CN1CCc2ccccc2C1
InChIInChI=1S/C18H20N4/c1-13-17(22-11-16(19)6-7-18(22)20-13)12-21-9-8-14-4-2-3-5-15(14)10-21/h2-7,11H,8-10,12,19H2,1H3
InChIKeyKAPOMLBONBSWGK-UHFFFAOYSA-N
MW292.39 g/mol
LogP2.78
Rot. Bonds2

About 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-methylimidazo[1,2-a]pyridin-6-amine

3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-methylimidazo[1,2-a]pyridin-6-amine (PubChem CID 82058437) has the molecular formula C18H20N4 and a molecular weight of 292.39 g/mol. Its IUPAC name is 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-methylimidazo[1,2-a]pyridin-6-amine.

Molecular Properties

Compound Name3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-methylimidazo[1,2-a]pyridin-6-amine
PubChem CID82058437
Molecular FormulaC18H20N4
Molecular Weight292.39 g/mol
Exact Mass292.17
IUPAC Name3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-methylimidazo[1,2-a]pyridin-6-amine
SMILESCc1nc2ccc(N)cn2c1CN1CCc2ccccc2C1
InChIInChI=1S/C18H20N4/c1-13-17(22-11-16(19)6-7-18(22)20-13)12-21-9-8-14-4-2-3-5-15(14)10-21/h2-7,11H,8-10,12,19H2,1H3
InChIKeyKAPOMLBONBSWGK-UHFFFAOYSA-N
XLogP2.78
TPSA46.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.39
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-6-amine
CID 82058473
2-methyl-3-[(4-methylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine
CID 82058433
4-[6-[(2,6-dimethylimidazo[1,2-a]pyridin-3-yl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]aniline
CID 24914634
2-methyl-3-[(3-methylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine
CID 82058431
6-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)imidazo[1,2-a]pyridine-2-carboxylic acid
CID 39122290
6-[(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-1,5,7,8-tetrahydropyrido[4,3-d]pyrimidine-2-thione
CID 24914650
2-[(6-amino-2-methylimidazo[1,2-a]pyridin-3-yl)methyl-methylamino]ethanol
CID 82058465
2-(4-methylphenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-6-amine
CID 165344231
6-[(2,6-dimethylimidazo[1,2-a]pyridin-3-yl)methyl]-2-[4-(trifluoromethyl)phenyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24914635
[6-chloro-3-[(4-methylpiperidin-1-yl)methyl]imidazo[1,2-a]pyridin-2-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone
CID 24817599
2-[(2-methylpyrimidin-5-yl)methyl]-3,4-dihydro-1H-isoquinoline
CID 140988917
1-[(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-3,4-dihydroquinolin-2-one
CID 122601681

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-methylimidazo[1,2-a]pyridin-6-amine?
The IUPAC name of 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-methylimidazo[1,2-a]pyridin-6-amine (CID 82058437) is 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-methylimidazo[1,2-a]pyridin-6-amine.
What is the SMILES notation for 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-methylimidazo[1,2-a]pyridin-6-amine?
The canonical SMILES for 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-methylimidazo[1,2-a]pyridin-6-amine is Cc1nc2ccc(N)cn2c1CN1CCc2ccccc2C1.
What is the InChIKey of 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-methylimidazo[1,2-a]pyridin-6-amine?
The InChIKey is KAPOMLBONBSWGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4/c1-13-17(22-11-16(19)6-7-18(22)20-13)12-21-9-8-14-4-2-3-5-15(14)10-21/h2-7,11H,8-10,12,19H2,1H3.
What are the key properties of 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-methylimidazo[1,2-a]pyridin-6-amine?
3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-methylimidazo[1,2-a]pyridin-6-amine has a molecular weight of 292.39 g/mol, XLogP of 2.78, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-methylimidazo[1,2-a]pyridin-6-amine is sourced from PubChem (CID 82058437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).