2-amino-5-methyl-N-(4-propan-2-yloxyphenyl)benzamide

C17H20N2O2 — CID 62510532

IUPAC2-amino-5-methyl-N-(4-propan-2-yloxyphenyl)benzamide
SMILESCc1ccc(N)c(C(=O)Nc2ccc(OC(C)C)cc2)c1
InChIInChI=1S/C17H20N2O2/c1-11(2)21-14-7-5-13(6-8-14)19-17(20)15-10-12(3)4-9-16(15)18/h4-11H,18H2,1-3H3,(H,19,20)
InChIKeyIICXXHIFGAXDOP-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.62
Rot. Bonds4

About 2-amino-5-methyl-N-(4-propan-2-yloxyphenyl)benzamide

2-amino-5-methyl-N-(4-propan-2-yloxyphenyl)benzamide (PubChem CID 62510532) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-amino-5-methyl-N-(4-propan-2-yloxyphenyl)benzamide.

Molecular Properties

Compound Name2-amino-5-methyl-N-(4-propan-2-yloxyphenyl)benzamide
PubChem CID62510532
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name2-amino-5-methyl-N-(4-propan-2-yloxyphenyl)benzamide
SMILESCc1ccc(N)c(C(=O)Nc2ccc(OC(C)C)cc2)c1
InChIInChI=1S/C17H20N2O2/c1-11(2)21-14-7-5-13(6-8-14)19-17(20)15-10-12(3)4-9-16(15)18/h4-11H,18H2,1-3H3,(H,19,20)
InChIKeyIICXXHIFGAXDOP-UHFFFAOYSA-N
XLogP3.62
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-amino-5-methyl-N-(4-propan-2-yloxyphenyl)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

2-amino-N-(4-tert-butylphenyl)-5-methylbenzamide
CID 62059196
4-amino-6-methyl-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 81238735
4-amino-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 81235962
2-amino-4-fluoro-N-(4-propan-2-yloxyphenyl)benzamide
CID 63109637
3-N-(3-methylphenyl)-1-N-(4-propan-2-yloxyphenyl)benzene-1,3-dicarboxamide
CID 109056925
2-amino-N-(3-methoxyphenyl)-5-methylbenzamide
CID 55069541
2-amino-N-(4-methoxy-3-methylphenyl)-5-methylbenzamide
CID 62510394
2-amino-N-[4-(difluoromethoxy)phenyl]-5-hydroxybenzamide
CID 107073991
2-amino-5-chloro-N-(4-methylphenyl)benzamide
CID 6481532
2,5-dibromo-N-(4-propan-2-yloxyphenyl)benzamide
CID 114370108
2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide
CID 110761096
4-amino-3-nitro-N-(4-propan-2-yloxyphenyl)benzamide
CID 60516646

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-methyl-N-(4-propan-2-yloxyphenyl)benzamide?
The IUPAC name of 2-amino-5-methyl-N-(4-propan-2-yloxyphenyl)benzamide (CID 62510532) is 2-amino-5-methyl-N-(4-propan-2-yloxyphenyl)benzamide.
What is the SMILES notation for 2-amino-5-methyl-N-(4-propan-2-yloxyphenyl)benzamide?
The canonical SMILES for 2-amino-5-methyl-N-(4-propan-2-yloxyphenyl)benzamide is Cc1ccc(N)c(C(=O)Nc2ccc(OC(C)C)cc2)c1.
What is the InChIKey of 2-amino-5-methyl-N-(4-propan-2-yloxyphenyl)benzamide?
The InChIKey is IICXXHIFGAXDOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-11(2)21-14-7-5-13(6-8-14)19-17(20)15-10-12(3)4-9-16(15)18/h4-11H,18H2,1-3H3,(H,19,20).
What are the key properties of 2-amino-5-methyl-N-(4-propan-2-yloxyphenyl)benzamide?
2-amino-5-methyl-N-(4-propan-2-yloxyphenyl)benzamide has a molecular weight of 284.36 g/mol, XLogP of 3.62, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-methyl-N-(4-propan-2-yloxyphenyl)benzamide is sourced from PubChem (CID 62510532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).