2-amino-N,5-dimethyl-N-(3-methylbutan-2-yl)benzamide

C14H22N2O — CID 62510545

IUPAC2-amino-N,5-dimethyl-N-(3-methylbutan-2-yl)benzamide
SMILESCc1ccc(N)c(C(=O)N(C)C(C)C(C)C)c1
InChIInChI=1S/C14H22N2O/c1-9(2)11(4)16(5)14(17)12-8-10(3)6-7-13(12)15/h6-9,11H,15H2,1-5H3
InChIKeyTYYYKXKJZJNECY-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.69
Rot. Bonds3

About 2-amino-N,5-dimethyl-N-(3-methylbutan-2-yl)benzamide

2-amino-N,5-dimethyl-N-(3-methylbutan-2-yl)benzamide (PubChem CID 62510545) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-amino-N,5-dimethyl-N-(3-methylbutan-2-yl)benzamide.

Molecular Properties

Compound Name2-amino-N,5-dimethyl-N-(3-methylbutan-2-yl)benzamide
PubChem CID62510545
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-amino-N,5-dimethyl-N-(3-methylbutan-2-yl)benzamide
SMILESCc1ccc(N)c(C(=O)N(C)C(C)C(C)C)c1
InChIInChI=1S/C14H22N2O/c1-9(2)11(4)16(5)14(17)12-8-10(3)6-7-13(12)15/h6-9,11H,15H2,1-5H3
InChIKeyTYYYKXKJZJNECY-UHFFFAOYSA-N
XLogP2.69
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-bromo-N,5-dimethyl-N-(3-methylbutan-2-yl)benzamide
CID 80979920
2-amino-N,5-dimethyl-N-(1-methylsulfanylpropan-2-yl)benzamide
CID 112656503
2-amino-N-[1-(2-chlorophenyl)ethyl]-N,5-dimethylbenzamide
CID 62980696
2-(ethylamino)-N,5-dimethyl-N-(3-methylbutan-2-yl)benzamide
CID 62510547
6-amino-N-methyl-N-(3-methylbutan-2-yl)-1,3-benzodioxole-5-carboxamide
CID 103542861
2-amino-4-methoxy-N-methyl-N-(3-methylbutan-2-yl)benzamide
CID 113305134
5-amino-2,4-difluoro-N-methyl-N-(3-methylbutan-2-yl)benzamide
CID 61093096
2-amino-N-[2-(dimethylamino)propyl]-5-methylbenzamide
CID 62508707
2-amino-5-methyl-N,N-dipropylbenzamide
CID 62073624
2-amino-N-cyclopentyl-N,5-dimethylbenzamide
CID 62509333
2-amino-N-(1-hydroxy-2-methylpropan-2-yl)-N,5-dimethylbenzamide
CID 113475389
2-amino-N,5-dimethyl-N-(2-methylbutan-2-yl)benzamide
CID 63962505

Frequently Asked Questions

What is the IUPAC name of 2-amino-N,5-dimethyl-N-(3-methylbutan-2-yl)benzamide?
The IUPAC name of 2-amino-N,5-dimethyl-N-(3-methylbutan-2-yl)benzamide (CID 62510545) is 2-amino-N,5-dimethyl-N-(3-methylbutan-2-yl)benzamide.
What is the SMILES notation for 2-amino-N,5-dimethyl-N-(3-methylbutan-2-yl)benzamide?
The canonical SMILES for 2-amino-N,5-dimethyl-N-(3-methylbutan-2-yl)benzamide is Cc1ccc(N)c(C(=O)N(C)C(C)C(C)C)c1.
What is the InChIKey of 2-amino-N,5-dimethyl-N-(3-methylbutan-2-yl)benzamide?
The InChIKey is TYYYKXKJZJNECY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-9(2)11(4)16(5)14(17)12-8-10(3)6-7-13(12)15/h6-9,11H,15H2,1-5H3.
What are the key properties of 2-amino-N,5-dimethyl-N-(3-methylbutan-2-yl)benzamide?
2-amino-N,5-dimethyl-N-(3-methylbutan-2-yl)benzamide has a molecular weight of 234.34 g/mol, XLogP of 2.69, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N,5-dimethyl-N-(3-methylbutan-2-yl)benzamide is sourced from PubChem (CID 62510545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).