1-[7-(aminomethyl)-6-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine

C17H18Cl2N4 — CID 66659374

IUPAC1-[7-(aminomethyl)-6-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine
SMILESCCC(N)c1cnc2cc(CN)c(-c3ccc(Cl)cc3Cl)cn12
InChIInChI=1S/C17H18Cl2N4/c1-2-15(21)16-8-22-17-5-10(7-20)13(9-23(16)17)12-4-3-11(18)6-14(12)19/h3-6,8-9,15H,2,7,20-21H2,1H3
InChIKeyOLYMZGWWOWGMJH-UHFFFAOYSA-N
MW349.27 g/mol
LogP4.18
Rot. Bonds4

About 1-[7-(aminomethyl)-6-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine

1-[7-(aminomethyl)-6-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine (PubChem CID 66659374) has the molecular formula C17H18Cl2N4 and a molecular weight of 349.27 g/mol. Its IUPAC name is 1-[7-(aminomethyl)-6-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine.

Molecular Properties

Compound Name1-[7-(aminomethyl)-6-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine
PubChem CID66659374
Molecular FormulaC17H18Cl2N4
Molecular Weight349.27 g/mol
Exact Mass348.09
IUPAC Name1-[7-(aminomethyl)-6-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine
SMILESCCC(N)c1cnc2cc(CN)c(-c3ccc(Cl)cc3Cl)cn12
InChIInChI=1S/C17H18Cl2N4/c1-2-15(21)16-8-22-17-5-10(7-20)13(9-23(16)17)12-4-3-11(18)6-14(12)19/h3-6,8-9,15H,2,7,20-21H2,1H3
InChIKeyOLYMZGWWOWGMJH-UHFFFAOYSA-N
XLogP4.18
TPSA69.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.27
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[7-(aminomethyl)-6-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine?
The IUPAC name of 1-[7-(aminomethyl)-6-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine (CID 66659374) is 1-[7-(aminomethyl)-6-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine.
What is the SMILES notation for 1-[7-(aminomethyl)-6-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine?
The canonical SMILES for 1-[7-(aminomethyl)-6-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine is CCC(N)c1cnc2cc(CN)c(-c3ccc(Cl)cc3Cl)cn12.
What is the InChIKey of 1-[7-(aminomethyl)-6-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine?
The InChIKey is OLYMZGWWOWGMJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2N4/c1-2-15(21)16-8-22-17-5-10(7-20)13(9-23(16)17)12-4-3-11(18)6-14(12)19/h3-6,8-9,15H,2,7,20-21H2,1H3.
What are the key properties of 1-[7-(aminomethyl)-6-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine?
1-[7-(aminomethyl)-6-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine has a molecular weight of 349.27 g/mol, XLogP of 4.18, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[7-(aminomethyl)-6-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine is sourced from PubChem (CID 66659374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).