N-[2-(methylamino)ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride

C19H24Cl2N4O2 — CID 119502756

IUPACN-[2-(methylamino)ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride
SMILESCNCCNC(=O)c1ccccc1OCc1cn2cccc(C)c2n1.Cl.Cl
InChIInChI=1S/C19H22N4O2.2ClH/c1-14-6-5-11-23-12-15(22-18(14)23)13-25-17-8-4-3-7-16(17)19(24)21-10-9-20-2;;/h3-8,11-12,20H,9-10,13H2,1-2H3,(H,21,24);2*1H
InChIKeyMHKTXWIOOHKJTJ-UHFFFAOYSA-N
MW411.33 g/mol
LogP3.01
Rot. Bonds7

About N-[2-(methylamino)ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride

N-[2-(methylamino)ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride (PubChem CID 119502756) has the molecular formula C19H24Cl2N4O2 and a molecular weight of 411.33 g/mol. Its IUPAC name is N-[2-(methylamino)ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride.

Molecular Properties

Compound NameN-[2-(methylamino)ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride
PubChem CID119502756
Molecular FormulaC19H24Cl2N4O2
Molecular Weight411.33 g/mol
Exact Mass410.13
IUPAC NameN-[2-(methylamino)ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride
SMILESCNCCNC(=O)c1ccccc1OCc1cn2cccc(C)c2n1.Cl.Cl
InChIInChI=1S/C19H22N4O2.2ClH/c1-14-6-5-11-23-12-15(22-18(14)23)13-25-17-8-4-3-7-16(17)19(24)21-10-9-20-2;;/h3-8,11-12,20H,9-10,13H2,1-2H3,(H,21,24);2*1H
InChIKeyMHKTXWIOOHKJTJ-UHFFFAOYSA-N
XLogP3.01
TPSA67.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.33
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-[(4-hydroxybenzoyl)amino]ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 138044528
N-[2-(methylamino)propyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride
CID 120831701
N-(2-amino-2-methylpropyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 119628901
N-(3-anilinopropyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 56541690
N-[(4-fluorophenyl)methyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 24616146
N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 55635787
N'-(4-methoxybenzoyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzohydrazide
CID 24653958
N-[(2S)-1-aminopropan-2-yl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride
CID 120509223
N-[3-(2-methylbenzimidazol-1-yl)propyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 55522635
N-[4-(methylcarbamoyl)phenyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 18278813
N-ethyl-N-methyl-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 134005773
N-(3-fluoro-4-methylphenyl)-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 24617135

Frequently Asked Questions

What is the IUPAC name of N-[2-(methylamino)ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride?
The IUPAC name of N-[2-(methylamino)ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride (CID 119502756) is N-[2-(methylamino)ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride.
What is the SMILES notation for N-[2-(methylamino)ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride?
The canonical SMILES for N-[2-(methylamino)ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride is CNCCNC(=O)c1ccccc1OCc1cn2cccc(C)c2n1.Cl.Cl.
What is the InChIKey of N-[2-(methylamino)ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride?
The InChIKey is MHKTXWIOOHKJTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2.2ClH/c1-14-6-5-11-23-12-15(22-18(14)23)13-25-17-8-4-3-7-16(17)19(24)21-10-9-20-2;;/h3-8,11-12,20H,9-10,13H2,1-2H3,(H,21,24);2*1H.
What are the key properties of N-[2-(methylamino)ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride?
N-[2-(methylamino)ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride has a molecular weight of 411.33 g/mol, XLogP of 3.01, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methylamino)ethyl]-2-[(8-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide;dihydrochloride is sourced from PubChem (CID 119502756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).