5-amino-2-(ethylamino)-N-methylbenzamide

C10H15N3O — CID 100637917

IUPAC5-amino-2-(ethylamino)-N-methylbenzamide
SMILESCCNc1ccc(N)cc1C(=O)NC
InChIInChI=1S/C10H15N3O/c1-3-13-9-5-4-7(11)6-8(9)10(14)12-2/h4-6,13H,3,11H2,1-2H3,(H,12,14)
InChIKeyNUFCMIXLYIDGOK-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.06
Rot. Bonds3

About 5-amino-2-(ethylamino)-N-methylbenzamide

5-amino-2-(ethylamino)-N-methylbenzamide (PubChem CID 100637917) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 5-amino-2-(ethylamino)-N-methylbenzamide.

Molecular Properties

Compound Name5-amino-2-(ethylamino)-N-methylbenzamide
PubChem CID100637917
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name5-amino-2-(ethylamino)-N-methylbenzamide
SMILESCCNc1ccc(N)cc1C(=O)NC
InChIInChI=1S/C10H15N3O/c1-3-13-9-5-4-7(11)6-8(9)10(14)12-2/h4-6,13H,3,11H2,1-2H3,(H,12,14)
InChIKeyNUFCMIXLYIDGOK-UHFFFAOYSA-N
XLogP1.06
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-amino-N-methyl-2-(prop-2-enylamino)benzamide
CID 100639501
5-amino-2-(ethylamino)-N-(2-methoxyethyl)benzamide
CID 100638026
5-amino-2-(3-ethoxypropylamino)-N-methylbenzamide
CID 100653033
ethyl 5-amino-2-(ethylamino)benzoate
CID 61313445
propyl 5-amino-2-(ethylamino)benzoate
CID 100637868
5-amino-2-(cyclopropylamino)-N-methylbenzamide
CID 100639685
5-amino-N-methyl-2-[[(2R)-oxolan-2-yl]methylamino]benzamide
CID 100641777
5-amino-N-methyl-2-(2-morpholin-4-ylethylamino)benzamide
CID 100655710
5-amino-2-(ethylamino)-N-[(1R)-1-naphthalen-1-ylethyl]benzamide
CID 163231886
5-amino-N-ethyl-2-(3-methoxypropylamino)benzamide
CID 100640478
5-amino-2-(cyclooctylamino)-N-methylbenzamide
CID 100655350
5-amino-N-cyclopropyl-2-(propylamino)benzamide
CID 100638190

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-(ethylamino)-N-methylbenzamide?
The IUPAC name of 5-amino-2-(ethylamino)-N-methylbenzamide (CID 100637917) is 5-amino-2-(ethylamino)-N-methylbenzamide.
What is the SMILES notation for 5-amino-2-(ethylamino)-N-methylbenzamide?
The canonical SMILES for 5-amino-2-(ethylamino)-N-methylbenzamide is CCNc1ccc(N)cc1C(=O)NC.
What is the InChIKey of 5-amino-2-(ethylamino)-N-methylbenzamide?
The InChIKey is NUFCMIXLYIDGOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-3-13-9-5-4-7(11)6-8(9)10(14)12-2/h4-6,13H,3,11H2,1-2H3,(H,12,14).
What are the key properties of 5-amino-2-(ethylamino)-N-methylbenzamide?
5-amino-2-(ethylamino)-N-methylbenzamide has a molecular weight of 193.25 g/mol, XLogP of 1.06, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-(ethylamino)-N-methylbenzamide is sourced from PubChem (CID 100637917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).