4-amino-5-chloro-2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]benzamide

C18H21ClN4O3 — CID 119847226

IUPAC4-amino-5-chloro-2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]benzamide
SMILESCOc1cc(N)c(Cl)cc1C(=O)NCc1cccnc1N1CCOCC1
InChIInChI=1S/C18H21ClN4O3/c1-25-16-10-15(20)14(19)9-13(16)18(24)22-11-12-3-2-4-21-17(12)23-5-7-26-8-6-23/h2-4,9-10H,5-8,11,20H2,1H3,(H,22,24)
InChIKeyMVLZVVJSUDWVFJ-UHFFFAOYSA-N
MW376.84 g/mol
LogP2.09
Rot. Bonds5

About 4-amino-5-chloro-2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]benzamide

4-amino-5-chloro-2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]benzamide (PubChem CID 119847226) has the molecular formula C18H21ClN4O3 and a molecular weight of 376.84 g/mol. Its IUPAC name is 4-amino-5-chloro-2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]benzamide.

Molecular Properties

Compound Name4-amino-5-chloro-2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]benzamide
PubChem CID119847226
Molecular FormulaC18H21ClN4O3
Molecular Weight376.84 g/mol
Exact Mass376.13
IUPAC Name4-amino-5-chloro-2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]benzamide
SMILESCOc1cc(N)c(Cl)cc1C(=O)NCc1cccnc1N1CCOCC1
InChIInChI=1S/C18H21ClN4O3/c1-25-16-10-15(20)14(19)9-13(16)18(24)22-11-12-3-2-4-21-17(12)23-5-7-26-8-6-23/h2-4,9-10H,5-8,11,20H2,1H3,(H,22,24)
InChIKeyMVLZVVJSUDWVFJ-UHFFFAOYSA-N
XLogP2.09
TPSA89.71 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.84
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 4-amino-5-chloro-2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]benzamide 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

4-amino-5-chloro-2-methoxy-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]benzamide;dihydrochloride
CID 119834795
3-chloro-5-methoxy-4-(3-methylbutoxy)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]benzamide
CID 38540995
4-amino-5-chloro-2-methoxy-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide
CID 119830234
4-amino-5-chloro-N-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-methoxybenzamide
CID 119835495
N-[(3-chloro-4,5-dimethoxyphenyl)methyl]-1-(2-morpholin-4-yl-3-pyridinyl)methanamine
CID 38051144
4-amino-5-chloro-2-methoxy-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]benzamide
CID 119836255
1-ethyl-3-[(2-morpholin-4-yl-3-pyridinyl)methyl]urea
CID 47226420
1-benzyl-5-ethyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]pyrazole-4-carboxamide
CID 78872062
N-(3-amino-4-methoxyphenyl)-2-morpholin-4-ylpyridine-3-carboxamide
CID 119419635
4-amino-5-chloro-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-2-methoxybenzamide;hydrochloride
CID 119756204
3-methyl-5-(methylamino)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]-1,2-thiazole-4-carboxamide
CID 38544423
6-chloro-2-methyl-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 56749997

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-chloro-2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]benzamide?
The IUPAC name of 4-amino-5-chloro-2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]benzamide (CID 119847226) is 4-amino-5-chloro-2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]benzamide.
What is the SMILES notation for 4-amino-5-chloro-2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]benzamide?
The canonical SMILES for 4-amino-5-chloro-2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]benzamide is COc1cc(N)c(Cl)cc1C(=O)NCc1cccnc1N1CCOCC1.
What is the InChIKey of 4-amino-5-chloro-2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]benzamide?
The InChIKey is MVLZVVJSUDWVFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21ClN4O3/c1-25-16-10-15(20)14(19)9-13(16)18(24)22-11-12-3-2-4-21-17(12)23-5-7-26-8-6-23/h2-4,9-10H,5-8,11,20H2,1H3,(H,22,24).
What are the key properties of 4-amino-5-chloro-2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]benzamide?
4-amino-5-chloro-2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]benzamide has a molecular weight of 376.84 g/mol, XLogP of 2.09, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-chloro-2-methoxy-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]benzamide is sourced from PubChem (CID 119847226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).