5-amino-N-methyl-2-(2-morpholin-4-ylethylamino)benzamide

C14H22N4O2 — CID 100655710

IUPAC5-amino-N-methyl-2-(2-morpholin-4-ylethylamino)benzamide
SMILESCNC(=O)c1cc(N)ccc1NCCN1CCOCC1
InChIInChI=1S/C14H22N4O2/c1-16-14(19)12-10-11(15)2-3-13(12)17-4-5-18-6-8-20-9-7-18/h2-3,10,17H,4-9,15H2,1H3,(H,16,19)
InChIKeyJRIIWROYMADGNR-UHFFFAOYSA-N
MW278.36 g/mol
LogP0.37
Rot. Bonds5

About 5-amino-N-methyl-2-(2-morpholin-4-ylethylamino)benzamide

5-amino-N-methyl-2-(2-morpholin-4-ylethylamino)benzamide (PubChem CID 100655710) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 5-amino-N-methyl-2-(2-morpholin-4-ylethylamino)benzamide.

Molecular Properties

Compound Name5-amino-N-methyl-2-(2-morpholin-4-ylethylamino)benzamide
PubChem CID100655710
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name5-amino-N-methyl-2-(2-morpholin-4-ylethylamino)benzamide
SMILESCNC(=O)c1cc(N)ccc1NCCN1CCOCC1
InChIInChI=1S/C14H22N4O2/c1-16-14(19)12-10-11(15)2-3-13(12)17-4-5-18-6-8-20-9-7-18/h2-3,10,17H,4-9,15H2,1H3,(H,16,19)
InChIKeyJRIIWROYMADGNR-UHFFFAOYSA-N
XLogP0.37
TPSA79.62 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-1-N-(2-morpholin-4-ylethyl)benzene-1,4-diamine
CID 28904413
5-amino-2-(ethylamino)-N-methylbenzamide
CID 100637917
5-amino-2-fluoro-N-(2-morpholin-4-ylethyl)benzamide
CID 43510748
ethyl 5-amino-2-(2-pyrrolidin-1-ylethylamino)benzoate
CID 62642562
4-amino-N-methyl-3-(3-morpholin-4-ylpropylamino)benzamide
CID 63357336
methyl 5-amino-2-(2-thiomorpholin-4-ylethylamino)benzoate
CID 106326870
2-fluoro-1-N-(4-morpholin-4-ylbutyl)benzene-1,4-diamine
CID 90022894
4-methyl-3-N-(3-morpholin-4-ylpropyl)benzene-1,3-diamine
CID 55091459
5-amino-2-(3-ethoxypropylamino)-N-methylbenzamide
CID 100653033
2-amino-3-(2-morpholin-4-ylethylamino)benzamide
CID 113332479
5-amino-N-methyl-2-[[(2R)-oxolan-2-yl]methylamino]benzamide
CID 100641777
5-amino-N-methyl-2-(prop-2-enylamino)benzamide
CID 100639501

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-methyl-2-(2-morpholin-4-ylethylamino)benzamide?
The IUPAC name of 5-amino-N-methyl-2-(2-morpholin-4-ylethylamino)benzamide (CID 100655710) is 5-amino-N-methyl-2-(2-morpholin-4-ylethylamino)benzamide.
What is the SMILES notation for 5-amino-N-methyl-2-(2-morpholin-4-ylethylamino)benzamide?
The canonical SMILES for 5-amino-N-methyl-2-(2-morpholin-4-ylethylamino)benzamide is CNC(=O)c1cc(N)ccc1NCCN1CCOCC1.
What is the InChIKey of 5-amino-N-methyl-2-(2-morpholin-4-ylethylamino)benzamide?
The InChIKey is JRIIWROYMADGNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-16-14(19)12-10-11(15)2-3-13(12)17-4-5-18-6-8-20-9-7-18/h2-3,10,17H,4-9,15H2,1H3,(H,16,19).
What are the key properties of 5-amino-N-methyl-2-(2-morpholin-4-ylethylamino)benzamide?
5-amino-N-methyl-2-(2-morpholin-4-ylethylamino)benzamide has a molecular weight of 278.36 g/mol, XLogP of 0.37, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-methyl-2-(2-morpholin-4-ylethylamino)benzamide is sourced from PubChem (CID 100655710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).