N-[(2R)-2-(ethylamino)propyl]-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride

C21H28Cl2N4O2 — CID 120653338

IUPACN-[(2R)-2-(ethylamino)propyl]-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride
SMILESCCN[C@H](C)CNC(=O)c1ccccc1OCc1cn2cc(C)ccc2n1.Cl.Cl
InChIInChI=1S/C21H26N4O2.2ClH/c1-4-22-16(3)11-23-21(26)18-7-5-6-8-19(18)27-14-17-13-25-12-15(2)9-10-20(25)24-17;;/h5-10,12-13,16,22H,4,11,14H2,1-3H3,(H,23,26);2*1H/t16-;;/m1../s1
InChIKeyIZZGXJYRHDLARJ-GGMCWBHBSA-N
MW439.39 g/mol
LogP3.79
Rot. Bonds8

About N-[(2R)-2-(ethylamino)propyl]-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride

N-[(2R)-2-(ethylamino)propyl]-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride (PubChem CID 120653338) has the molecular formula C21H28Cl2N4O2 and a molecular weight of 439.39 g/mol. Its IUPAC name is N-[(2R)-2-(ethylamino)propyl]-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride.

Molecular Properties

Compound NameN-[(2R)-2-(ethylamino)propyl]-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride
PubChem CID120653338
Molecular FormulaC21H28Cl2N4O2
Molecular Weight439.39 g/mol
Exact Mass438.16
IUPAC NameN-[(2R)-2-(ethylamino)propyl]-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride
SMILESCCN[C@H](C)CNC(=O)c1ccccc1OCc1cn2cc(C)ccc2n1.Cl.Cl
InChIInChI=1S/C21H26N4O2.2ClH/c1-4-22-16(3)11-23-21(26)18-7-5-6-8-19(18)27-14-17-13-25-12-15(2)9-10-20(25)24-17;;/h5-10,12-13,16,22H,4,11,14H2,1-3H3,(H,23,26);2*1H/t16-;;/m1../s1
InChIKeyIZZGXJYRHDLARJ-GGMCWBHBSA-N
XLogP3.79
TPSA67.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.39
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2R)-2-(ethylamino)propyl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride
CID 120654182
N-(2-amino-2-methylpropyl)-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride
CID 119629513
N-(3-hydroxypropyl)-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 78876020
2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-[(4-propan-2-yl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]benzamide
CID 86902264
N-[2-(methylamino)propyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride
CID 120831701
N-[(2R)-2-(ethylamino)propyl]-2-methoxybenzamide
CID 120650635
N-[(2R)-2-(ethylamino)propyl]-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]acetamide
CID 120654185
N-[(2R)-2-(ethylamino)propyl]-2-prop-2-enoxybenzamide
CID 120651699
[2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]-piperazin-1-ylmethanone
CID 119402980
[(3R)-3-aminopyrrolidin-1-yl]-[2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]methanone;dihydrochloride
CID 119412488
ethyl 4-[[2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzoyl]amino]benzoate
CID 18288936
N-(4-bromo-3-methylphenyl)-2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 18266560

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(ethylamino)propyl]-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride?
The IUPAC name of N-[(2R)-2-(ethylamino)propyl]-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride (CID 120653338) is N-[(2R)-2-(ethylamino)propyl]-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride.
What is the SMILES notation for N-[(2R)-2-(ethylamino)propyl]-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride?
The canonical SMILES for N-[(2R)-2-(ethylamino)propyl]-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride is CCN[C@H](C)CNC(=O)c1ccccc1OCc1cn2cc(C)ccc2n1.Cl.Cl.
What is the InChIKey of N-[(2R)-2-(ethylamino)propyl]-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride?
The InChIKey is IZZGXJYRHDLARJ-GGMCWBHBSA-N. The full InChI is InChI=1S/C21H26N4O2.2ClH/c1-4-22-16(3)11-23-21(26)18-7-5-6-8-19(18)27-14-17-13-25-12-15(2)9-10-20(25)24-17;;/h5-10,12-13,16,22H,4,11,14H2,1-3H3,(H,23,26);2*1H/t16-;;/m1../s1.
What are the key properties of N-[(2R)-2-(ethylamino)propyl]-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride?
N-[(2R)-2-(ethylamino)propyl]-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride has a molecular weight of 439.39 g/mol, XLogP of 3.79, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(ethylamino)propyl]-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride is sourced from PubChem (CID 120653338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).