N-(3-amino-4-methylphenyl)-2-[methyl(2-methylbutan-2-yl)amino]acetamide

C15H25N3O — CID 63983055

IUPACN-(3-amino-4-methylphenyl)-2-[methyl(2-methylbutan-2-yl)amino]acetamide
SMILESCCC(C)(C)N(C)CC(=O)Nc1ccc(C)c(N)c1
InChIInChI=1S/C15H25N3O/c1-6-15(3,4)18(5)10-14(19)17-12-8-7-11(2)13(16)9-12/h7-9H,6,10,16H2,1-5H3,(H,17,19)
InChIKeyCZBUSBOSPSCMBC-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.64
Rot. Bonds5

About N-(3-amino-4-methylphenyl)-2-[methyl(2-methylbutan-2-yl)amino]acetamide

N-(3-amino-4-methylphenyl)-2-[methyl(2-methylbutan-2-yl)amino]acetamide (PubChem CID 63983055) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-(3-amino-4-methylphenyl)-2-[methyl(2-methylbutan-2-yl)amino]acetamide.

Molecular Properties

Compound NameN-(3-amino-4-methylphenyl)-2-[methyl(2-methylbutan-2-yl)amino]acetamide
PubChem CID63983055
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-(3-amino-4-methylphenyl)-2-[methyl(2-methylbutan-2-yl)amino]acetamide
SMILESCCC(C)(C)N(C)CC(=O)Nc1ccc(C)c(N)c1
InChIInChI=1S/C15H25N3O/c1-6-15(3,4)18(5)10-14(19)17-12-8-7-11(2)13(16)9-12/h7-9H,6,10,16H2,1-5H3,(H,17,19)
InChIKeyCZBUSBOSPSCMBC-UHFFFAOYSA-N
XLogP2.64
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-amino-4-chlorophenyl)-2-[methyl(2-methylbutan-2-yl)amino]acetamide
CID 63982422
N-(3-amino-4-methylphenyl)-2-[ethyl(2-methylpropyl)amino]acetamide
CID 43376006
N-(3-amino-4-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide
CID 43375929
2-amino-N-(3-amino-4-methylphenyl)acetamide
CID 146654157
N-(3-amino-4-methylphenyl)-4-methylpentanamide
CID 28776905
N-(3-amino-4-methylphenyl)-2-(3,4-dimethylphenyl)acetamide
CID 62057767
N-(3-amino-4-methylphenyl)-2-[cyclopropylmethyl(ethyl)amino]acetamide
CID 63954898
N-(3-amino-4-methylphenyl)-2-[2-ethoxyethyl(ethyl)amino]acetamide
CID 63698404
N-(3-amino-4-methylphenyl)-2-[2-cyanoethyl(ethyl)amino]acetamide
CID 54988249
2-[2-(3-amino-4-methylanilino)-2-oxoethyl]sulfanylacetamide
CID 114231285
N-(3-amino-4-methylphenyl)-2-[methyl(pyridin-3-ylmethyl)amino]acetamide
CID 43563094
N-(3-amino-4-methylphenyl)-2-(2-chlorophenyl)acetamide
CID 24694774

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methylphenyl)-2-[methyl(2-methylbutan-2-yl)amino]acetamide?
The IUPAC name of N-(3-amino-4-methylphenyl)-2-[methyl(2-methylbutan-2-yl)amino]acetamide (CID 63983055) is N-(3-amino-4-methylphenyl)-2-[methyl(2-methylbutan-2-yl)amino]acetamide.
What is the SMILES notation for N-(3-amino-4-methylphenyl)-2-[methyl(2-methylbutan-2-yl)amino]acetamide?
The canonical SMILES for N-(3-amino-4-methylphenyl)-2-[methyl(2-methylbutan-2-yl)amino]acetamide is CCC(C)(C)N(C)CC(=O)Nc1ccc(C)c(N)c1.
What is the InChIKey of N-(3-amino-4-methylphenyl)-2-[methyl(2-methylbutan-2-yl)amino]acetamide?
The InChIKey is CZBUSBOSPSCMBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-6-15(3,4)18(5)10-14(19)17-12-8-7-11(2)13(16)9-12/h7-9H,6,10,16H2,1-5H3,(H,17,19).
What are the key properties of N-(3-amino-4-methylphenyl)-2-[methyl(2-methylbutan-2-yl)amino]acetamide?
N-(3-amino-4-methylphenyl)-2-[methyl(2-methylbutan-2-yl)amino]acetamide has a molecular weight of 263.38 g/mol, XLogP of 2.64, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methylphenyl)-2-[methyl(2-methylbutan-2-yl)amino]acetamide is sourced from PubChem (CID 63983055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).