2-amino-3-morpholin-3-ylbenzamide

C11H15N3O2 — CID 18403948

IUPAC2-amino-3-morpholin-3-ylbenzamide
SMILESNC(=O)c1cccc(C2COCCN2)c1N
InChIInChI=1S/C11H15N3O2/c12-10-7(9-6-16-5-4-14-9)2-1-3-8(10)11(13)15/h1-3,9,14H,4-6,12H2,(H2,13,15)
InChIKeyNZCPEAVWMDAWHQ-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.03
Rot. Bonds2

About 2-amino-3-morpholin-3-ylbenzamide

2-amino-3-morpholin-3-ylbenzamide (PubChem CID 18403948) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is 2-amino-3-morpholin-3-ylbenzamide.

Molecular Properties

Compound Name2-amino-3-morpholin-3-ylbenzamide
PubChem CID18403948
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name2-amino-3-morpholin-3-ylbenzamide
SMILESNC(=O)c1cccc(C2COCCN2)c1N
InChIInChI=1S/C11H15N3O2/c12-10-7(9-6-16-5-4-14-9)2-1-3-8(10)11(13)15/h1-3,9,14H,4-6,12H2,(H2,13,15)
InChIKeyNZCPEAVWMDAWHQ-UHFFFAOYSA-N
XLogP0.03
TPSA90.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-amino-3-morpholin-3-ylbenzamide 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-Fluoro-3-morpholin-3-yl-2-nitrophenyl)-phenylmethanone
CID 174960854
2-amino-3-fluoro-N-(oxan-2-ylmethyl)benzamide
CID 62662241
2-amino-5-fluoro-N-(oxan-3-yl)benzamide
CID 63360258
2-amino-4-fluoro-N-(oxan-3-yl)benzamide
CID 63361462
4-amino-N-(oxan-3-yl)-3-(trifluoromethyl)benzamide
CID 63362160
2-amino-3-fluoro-N-(oxan-3-yl)benzamide
CID 63362448
2-amino-N-(oxan-3-yl)-3-(trifluoromethyl)benzamide
CID 80028294
2-amino-N-(oxan-4-yl)-3-(trifluoromethyl)benzamide
CID 80028891
2-(methylamino)-N-(oxan-3-yl)-3-(trifluoromethyl)benzamide
CID 80033856
2-amino-N-(oxan-4-ylmethyl)-3-(trifluoromethyl)benzamide
CID 80033873
2-amino-N-(1-methoxypentan-2-yl)-3-(trifluoromethyl)benzamide
CID 80034152
2-amino-N-(oxan-2-ylmethyl)-3-(trifluoromethyl)benzamide
CID 80037687

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-morpholin-3-ylbenzamide?
The IUPAC name of 2-amino-3-morpholin-3-ylbenzamide (CID 18403948) is 2-amino-3-morpholin-3-ylbenzamide.
What is the SMILES notation for 2-amino-3-morpholin-3-ylbenzamide?
The canonical SMILES for 2-amino-3-morpholin-3-ylbenzamide is NC(=O)c1cccc(C2COCCN2)c1N.
What is the InChIKey of 2-amino-3-morpholin-3-ylbenzamide?
The InChIKey is NZCPEAVWMDAWHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c12-10-7(9-6-16-5-4-14-9)2-1-3-8(10)11(13)15/h1-3,9,14H,4-6,12H2,(H2,13,15).
What are the key properties of 2-amino-3-morpholin-3-ylbenzamide?
2-amino-3-morpholin-3-ylbenzamide has a molecular weight of 221.26 g/mol, XLogP of 0.03, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-morpholin-3-ylbenzamide is sourced from PubChem (CID 18403948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).