(4-amino-3-methoxyphenyl)-[8-[2-(dimethylamino)ethoxy]imidazo[1,5-a]pyridin-3-yl]methanone;hydrochloride

C19H23ClN4O3 — CID 11851973

IUPAC(4-amino-3-methoxyphenyl)-[8-[2-(dimethylamino)ethoxy]imidazo[1,5-a]pyridin-3-yl]methanone;hydrochloride
SMILESCOc1cc(C(=O)c2ncc3c(OCCN(C)C)cccn23)ccc1N.Cl
InChIInChI=1S/C19H22N4O3.ClH/c1-22(2)9-10-26-16-5-4-8-23-15(16)12-21-19(23)18(24)13-6-7-14(20)17(11-13)25-3;/h4-8,11-12H,9-10,20H2,1-3H3;1H
InChIKeyGASNLHBNGMEVBG-UHFFFAOYSA-N
MW390.87 g/mol
LogP2.52
Rot. Bonds7

About (4-amino-3-methoxyphenyl)-[8-[2-(dimethylamino)ethoxy]imidazo[1,5-a]pyridin-3-yl]methanone;hydrochloride

(4-amino-3-methoxyphenyl)-[8-[2-(dimethylamino)ethoxy]imidazo[1,5-a]pyridin-3-yl]methanone;hydrochloride (PubChem CID 11851973) has the molecular formula C19H23ClN4O3 and a molecular weight of 390.87 g/mol. Its IUPAC name is (4-amino-3-methoxyphenyl)-[8-[2-(dimethylamino)ethoxy]imidazo[1,5-a]pyridin-3-yl]methanone;hydrochloride.

Molecular Properties

Compound Name(4-amino-3-methoxyphenyl)-[8-[2-(dimethylamino)ethoxy]imidazo[1,5-a]pyridin-3-yl]methanone;hydrochloride
PubChem CID11851973
Molecular FormulaC19H23ClN4O3
Molecular Weight390.87 g/mol
Exact Mass390.15
IUPAC Name(4-amino-3-methoxyphenyl)-[8-[2-(dimethylamino)ethoxy]imidazo[1,5-a]pyridin-3-yl]methanone;hydrochloride
SMILESCOc1cc(C(=O)c2ncc3c(OCCN(C)C)cccn23)ccc1N.Cl
InChIInChI=1S/C19H22N4O3.ClH/c1-22(2)9-10-26-16-5-4-8-23-15(16)12-21-19(23)18(24)13-6-7-14(20)17(11-13)25-3;/h4-8,11-12H,9-10,20H2,1-3H3;1H
InChIKeyGASNLHBNGMEVBG-UHFFFAOYSA-N
XLogP2.52
TPSA82.09 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.87
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

ethyl 2-[3-(4-amino-3-methoxybenzoyl)imidazo[1,5-a]pyridin-7-yl]oxyacetate;hydrochloride
CID 11851979
3-[3-(4-amino-3-methoxybenzoyl)imidazo[1,5-a]pyridin-1-yl]benzoic acid
CID 67216234
1-[3-amino-4-[2-(dimethylamino)ethoxy]phenyl]-2-methylpropan-1-one
CID 82064323
cyclohexyl 4-amino-3-[2-(dimethylamino)ethoxy]benzoate
CID 93204052
2-trimethylsilylethyl 4-amino-3-methoxybenzoate
CID 10778254
N-(2-acetamidoethyl)-4-amino-3-[2-(dimethylamino)ethoxy]benzamide
CID 93216697
3-[2-(dimethylamino)ethoxy]-4-methoxybenzenecarbothioamide
CID 22685297
2-(dimethylamino)ethyl 3,4-dimethoxybenzoate
CID 936334
4-amino-3-methoxy-N,N-dipropylbenzamide
CID 104782274
3-amino-4-[2-(dimethylamino)ethoxy]-N-methylbenzamide
CID 79021333
(4-amino-3-methoxyphenyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone
CID 104784944
3-amino-N-[2-(2-methoxyphenoxy)ethyl]-N,4-dimethylbenzamide
CID 86780225

Frequently Asked Questions

What is the IUPAC name of (4-amino-3-methoxyphenyl)-[8-[2-(dimethylamino)ethoxy]imidazo[1,5-a]pyridin-3-yl]methanone;hydrochloride?
The IUPAC name of (4-amino-3-methoxyphenyl)-[8-[2-(dimethylamino)ethoxy]imidazo[1,5-a]pyridin-3-yl]methanone;hydrochloride (CID 11851973) is (4-amino-3-methoxyphenyl)-[8-[2-(dimethylamino)ethoxy]imidazo[1,5-a]pyridin-3-yl]methanone;hydrochloride.
What is the SMILES notation for (4-amino-3-methoxyphenyl)-[8-[2-(dimethylamino)ethoxy]imidazo[1,5-a]pyridin-3-yl]methanone;hydrochloride?
The canonical SMILES for (4-amino-3-methoxyphenyl)-[8-[2-(dimethylamino)ethoxy]imidazo[1,5-a]pyridin-3-yl]methanone;hydrochloride is COc1cc(C(=O)c2ncc3c(OCCN(C)C)cccn23)ccc1N.Cl.
What is the InChIKey of (4-amino-3-methoxyphenyl)-[8-[2-(dimethylamino)ethoxy]imidazo[1,5-a]pyridin-3-yl]methanone;hydrochloride?
The InChIKey is GASNLHBNGMEVBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O3.ClH/c1-22(2)9-10-26-16-5-4-8-23-15(16)12-21-19(23)18(24)13-6-7-14(20)17(11-13)25-3;/h4-8,11-12H,9-10,20H2,1-3H3;1H.
What are the key properties of (4-amino-3-methoxyphenyl)-[8-[2-(dimethylamino)ethoxy]imidazo[1,5-a]pyridin-3-yl]methanone;hydrochloride?
(4-amino-3-methoxyphenyl)-[8-[2-(dimethylamino)ethoxy]imidazo[1,5-a]pyridin-3-yl]methanone;hydrochloride has a molecular weight of 390.87 g/mol, XLogP of 2.52, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-3-methoxyphenyl)-[8-[2-(dimethylamino)ethoxy]imidazo[1,5-a]pyridin-3-yl]methanone;hydrochloride is sourced from PubChem (CID 11851973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).