2-amino-6-methyl-N-(2-morpholin-4-ylethyl)benzamide

C14H21N3O2 — CID 16793479

IUPAC2-amino-6-methyl-N-(2-morpholin-4-ylethyl)benzamide
SMILESCc1cccc(N)c1C(=O)NCCN1CCOCC1
InChIInChI=1S/C14H21N3O2/c1-11-3-2-4-12(15)13(11)14(18)16-5-6-17-7-9-19-10-8-17/h2-4H,5-10,15H2,1H3,(H,16,18)
InChIKeyARGMKJLRKNHXMU-UHFFFAOYSA-N
MW263.34 g/mol
LogP0.64
Rot. Bonds4

About 2-amino-6-methyl-N-(2-morpholin-4-ylethyl)benzamide

2-amino-6-methyl-N-(2-morpholin-4-ylethyl)benzamide (PubChem CID 16793479) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-amino-6-methyl-N-(2-morpholin-4-ylethyl)benzamide.

Molecular Properties

Compound Name2-amino-6-methyl-N-(2-morpholin-4-ylethyl)benzamide
PubChem CID16793479
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name2-amino-6-methyl-N-(2-morpholin-4-ylethyl)benzamide
SMILESCc1cccc(N)c1C(=O)NCCN1CCOCC1
InChIInChI=1S/C14H21N3O2/c1-11-3-2-4-12(15)13(11)14(18)16-5-6-17-7-9-19-10-8-17/h2-4H,5-10,15H2,1H3,(H,16,18)
InChIKeyARGMKJLRKNHXMU-UHFFFAOYSA-N
XLogP0.64
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-methyl-N-(2-morpholin-4-ylethyl)benzamide?
The IUPAC name of 2-amino-6-methyl-N-(2-morpholin-4-ylethyl)benzamide (CID 16793479) is 2-amino-6-methyl-N-(2-morpholin-4-ylethyl)benzamide.
What is the SMILES notation for 2-amino-6-methyl-N-(2-morpholin-4-ylethyl)benzamide?
The canonical SMILES for 2-amino-6-methyl-N-(2-morpholin-4-ylethyl)benzamide is Cc1cccc(N)c1C(=O)NCCN1CCOCC1.
What is the InChIKey of 2-amino-6-methyl-N-(2-morpholin-4-ylethyl)benzamide?
The InChIKey is ARGMKJLRKNHXMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-11-3-2-4-12(15)13(11)14(18)16-5-6-17-7-9-19-10-8-17/h2-4H,5-10,15H2,1H3,(H,16,18).
What are the key properties of 2-amino-6-methyl-N-(2-morpholin-4-ylethyl)benzamide?
2-amino-6-methyl-N-(2-morpholin-4-ylethyl)benzamide has a molecular weight of 263.34 g/mol, XLogP of 0.64, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-methyl-N-(2-morpholin-4-ylethyl)benzamide is sourced from PubChem (CID 16793479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).