[4-amino-2-(3-chlorophenyl)-6-methyl-3H-imidazo[4,5-c]pyridin-7-yl]-morpholin-4-ylmethanone;hydrochloride

C18H19Cl2N5O2 — CID 69304518

IUPAC[4-amino-2-(3-chlorophenyl)-6-methyl-3H-imidazo[4,5-c]pyridin-7-yl]-morpholin-4-ylmethanone;hydrochloride
SMILESCc1nc(N)c2[nH]c(-c3cccc(Cl)c3)nc2c1C(=O)N1CCOCC1.Cl
InChIInChI=1S/C18H18ClN5O2.ClH/c1-10-13(18(25)24-5-7-26-8-6-24)14-15(16(20)21-10)23-17(22-14)11-3-2-4-12(19)9-11;/h2-4,9H,5-8H2,1H3,(H2,20,21)(H,22,23);1H
InChIKeyAVXSVOYAUJEBBN-UHFFFAOYSA-N
MW408.29 g/mol
LogP3.06
Rot. Bonds2

About [4-amino-2-(3-chlorophenyl)-6-methyl-3H-imidazo[4,5-c]pyridin-7-yl]-morpholin-4-ylmethanone;hydrochloride

[4-amino-2-(3-chlorophenyl)-6-methyl-3H-imidazo[4,5-c]pyridin-7-yl]-morpholin-4-ylmethanone;hydrochloride (PubChem CID 69304518) has the molecular formula C18H19Cl2N5O2 and a molecular weight of 408.29 g/mol. Its IUPAC name is [4-amino-2-(3-chlorophenyl)-6-methyl-3H-imidazo[4,5-c]pyridin-7-yl]-morpholin-4-ylmethanone;hydrochloride.

Molecular Properties

Compound Name[4-amino-2-(3-chlorophenyl)-6-methyl-3H-imidazo[4,5-c]pyridin-7-yl]-morpholin-4-ylmethanone;hydrochloride
PubChem CID69304518
Molecular FormulaC18H19Cl2N5O2
Molecular Weight408.29 g/mol
Exact Mass407.09
IUPAC Name[4-amino-2-(3-chlorophenyl)-6-methyl-3H-imidazo[4,5-c]pyridin-7-yl]-morpholin-4-ylmethanone;hydrochloride
SMILESCc1nc(N)c2[nH]c(-c3cccc(Cl)c3)nc2c1C(=O)N1CCOCC1.Cl
InChIInChI=1S/C18H18ClN5O2.ClH/c1-10-13(18(25)24-5-7-26-8-6-24)14-15(16(20)21-10)23-17(22-14)11-3-2-4-12(19)9-11;/h2-4,9H,5-8H2,1H3,(H2,20,21)(H,22,23);1H
InChIKeyAVXSVOYAUJEBBN-UHFFFAOYSA-N
XLogP3.06
TPSA97.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.29
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-amino-2-(3-chlorophenyl)-6-methyl-3H-imidazo[4,5-c]pyridin-7-yl]-morpholin-4-ylmethanone;hydrochloride?
The IUPAC name of [4-amino-2-(3-chlorophenyl)-6-methyl-3H-imidazo[4,5-c]pyridin-7-yl]-morpholin-4-ylmethanone;hydrochloride (CID 69304518) is [4-amino-2-(3-chlorophenyl)-6-methyl-3H-imidazo[4,5-c]pyridin-7-yl]-morpholin-4-ylmethanone;hydrochloride.
What is the SMILES notation for [4-amino-2-(3-chlorophenyl)-6-methyl-3H-imidazo[4,5-c]pyridin-7-yl]-morpholin-4-ylmethanone;hydrochloride?
The canonical SMILES for [4-amino-2-(3-chlorophenyl)-6-methyl-3H-imidazo[4,5-c]pyridin-7-yl]-morpholin-4-ylmethanone;hydrochloride is Cc1nc(N)c2[nH]c(-c3cccc(Cl)c3)nc2c1C(=O)N1CCOCC1.Cl.
What is the InChIKey of [4-amino-2-(3-chlorophenyl)-6-methyl-3H-imidazo[4,5-c]pyridin-7-yl]-morpholin-4-ylmethanone;hydrochloride?
The InChIKey is AVXSVOYAUJEBBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClN5O2.ClH/c1-10-13(18(25)24-5-7-26-8-6-24)14-15(16(20)21-10)23-17(22-14)11-3-2-4-12(19)9-11;/h2-4,9H,5-8H2,1H3,(H2,20,21)(H,22,23);1H.
What are the key properties of [4-amino-2-(3-chlorophenyl)-6-methyl-3H-imidazo[4,5-c]pyridin-7-yl]-morpholin-4-ylmethanone;hydrochloride?
[4-amino-2-(3-chlorophenyl)-6-methyl-3H-imidazo[4,5-c]pyridin-7-yl]-morpholin-4-ylmethanone;hydrochloride has a molecular weight of 408.29 g/mol, XLogP of 3.06, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-amino-2-(3-chlorophenyl)-6-methyl-3H-imidazo[4,5-c]pyridin-7-yl]-morpholin-4-ylmethanone;hydrochloride is sourced from PubChem (CID 69304518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).