N-(6-amino-3-pyridinyl)-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride

C18H26Cl2N4O2 — CID 119516313

IUPACN-(6-amino-3-pyridinyl)-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride
SMILESCCN(CC)CCOc1ccc(C(=O)Nc2ccc(N)nc2)cc1.Cl.Cl
InChIInChI=1S/C18H24N4O2.2ClH/c1-3-22(4-2)11-12-24-16-8-5-14(6-9-16)18(23)21-15-7-10-17(19)20-13-15;;/h5-10,13H,3-4,11-12H2,1-2H3,(H2,19,20)(H,21,23);2*1H
InChIKeyGWEAVRBLEOSEPB-UHFFFAOYSA-N
MW401.34 g/mol
LogP3.48
Rot. Bonds8

About N-(6-amino-3-pyridinyl)-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride

N-(6-amino-3-pyridinyl)-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride (PubChem CID 119516313) has the molecular formula C18H26Cl2N4O2 and a molecular weight of 401.34 g/mol. Its IUPAC name is N-(6-amino-3-pyridinyl)-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride.

Molecular Properties

Compound NameN-(6-amino-3-pyridinyl)-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride
PubChem CID119516313
Molecular FormulaC18H26Cl2N4O2
Molecular Weight401.34 g/mol
Exact Mass400.14
IUPAC NameN-(6-amino-3-pyridinyl)-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride
SMILESCCN(CC)CCOc1ccc(C(=O)Nc2ccc(N)nc2)cc1.Cl.Cl
InChIInChI=1S/C18H24N4O2.2ClH/c1-3-22(4-2)11-12-24-16-8-5-14(6-9-16)18(23)21-15-7-10-17(19)20-13-15;;/h5-10,13H,3-4,11-12H2,1-2H3,(H2,19,20)(H,21,23);2*1H
InChIKeyGWEAVRBLEOSEPB-UHFFFAOYSA-N
XLogP3.48
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.34
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(6-amino-3-pyridinyl)-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(6-amino-3-pyridinyl)-4-(3-methoxypropoxy)benzamide
CID 119515767
N-(2-amino-2-methylpropyl)-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride
CID 119629951
N-[2-(diethylamino)ethyl]-4-[[4-(2-methoxyethoxy)benzoyl]amino]benzamide
CID 17229819
4-[2-[ethyl(propyl)amino]ethoxy]benzohydrazide
CID 55213633
4-butoxy-N-(6-chloro-3-pyridinyl)benzamide
CID 54787952
N-(6-amino-3-pyridinyl)-4-iodobenzamide
CID 55132398
N-(6-amino-1,3-benzodioxol-5-yl)-4-[2-(diethylamino)ethoxy]benzamide
CID 119618898
4-butoxy-N-(6-methoxy-3-pyridinyl)benzamide
CID 7478576
N-(1-amino-2,3-dimethylbutan-2-yl)-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride
CID 119608481
N-[1-(aminomethyl)cyclopentyl]-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride
CID 119567915
4-(2-methoxyethoxy)-N-[4-(2-methoxyethoxy)phenyl]benzamide
CID 15943272
N-[4-[2-(diethylamino)ethoxy]phenyl]-4-(methylamino)-3-nitrobenzamide
CID 39155259

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-3-pyridinyl)-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride?
The IUPAC name of N-(6-amino-3-pyridinyl)-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride (CID 119516313) is N-(6-amino-3-pyridinyl)-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride.
What is the SMILES notation for N-(6-amino-3-pyridinyl)-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride?
The canonical SMILES for N-(6-amino-3-pyridinyl)-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride is CCN(CC)CCOc1ccc(C(=O)Nc2ccc(N)nc2)cc1.Cl.Cl.
What is the InChIKey of N-(6-amino-3-pyridinyl)-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride?
The InChIKey is GWEAVRBLEOSEPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2.2ClH/c1-3-22(4-2)11-12-24-16-8-5-14(6-9-16)18(23)21-15-7-10-17(19)20-13-15;;/h5-10,13H,3-4,11-12H2,1-2H3,(H2,19,20)(H,21,23);2*1H.
What are the key properties of N-(6-amino-3-pyridinyl)-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride?
N-(6-amino-3-pyridinyl)-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride has a molecular weight of 401.34 g/mol, XLogP of 3.48, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-3-pyridinyl)-4-[2-(diethylamino)ethoxy]benzamide;dihydrochloride is sourced from PubChem (CID 119516313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).