N-(2-amino-6-methylphenyl)-2-[butan-2-yl(ethyl)amino]acetamide

C15H25N3O — CID 43376010

IUPACN-(2-amino-6-methylphenyl)-2-[butan-2-yl(ethyl)amino]acetamide
SMILESCCC(C)N(CC)CC(=O)Nc1c(C)cccc1N
InChIInChI=1S/C15H25N3O/c1-5-12(4)18(6-2)10-14(19)17-15-11(3)8-7-9-13(15)16/h7-9,12H,5-6,10,16H2,1-4H3,(H,17,19)
InChIKeyINJQZLGHUUBBKZ-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.64
Rot. Bonds6

About N-(2-amino-6-methylphenyl)-2-[butan-2-yl(ethyl)amino]acetamide

N-(2-amino-6-methylphenyl)-2-[butan-2-yl(ethyl)amino]acetamide (PubChem CID 43376010) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-(2-amino-6-methylphenyl)-2-[butan-2-yl(ethyl)amino]acetamide.

Molecular Properties

Compound NameN-(2-amino-6-methylphenyl)-2-[butan-2-yl(ethyl)amino]acetamide
PubChem CID43376010
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-(2-amino-6-methylphenyl)-2-[butan-2-yl(ethyl)amino]acetamide
SMILESCCC(C)N(CC)CC(=O)Nc1c(C)cccc1N
InChIInChI=1S/C15H25N3O/c1-5-12(4)18(6-2)10-14(19)17-15-11(3)8-7-9-13(15)16/h7-9,12H,5-6,10,16H2,1-4H3,(H,17,19)
InChIKeyINJQZLGHUUBBKZ-UHFFFAOYSA-N
XLogP2.64
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
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-(2-amino-6-methylphenyl)-2-[ethyl(2-ethylbutyl)amino]acetamide
CID 43587408
N-(2-amino-6-methylphenyl)-2-(dipropylamino)acetamide
CID 43375546
N-(2-amino-6-methylphenyl)-2-[butyl(ethyl)amino]acetamide
CID 43375741
N-(2-amino-6-methylphenyl)-2-[1-cyanopropan-2-yl(methyl)amino]acetamide
CID 55174325
2-[[2-(2-amino-6-methylanilino)-2-oxoethyl]-methylamino]-N-methylacetamide
CID 43376076
N-(2-amino-6-methylphenyl)-2-(2-methylpropoxy)acetamide
CID 43376602
N-(2-amino-6-methylphenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide
CID 61444432
2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-propan-2-ylamino]acetamide
CID 40760037
N-[3-(aminomethyl)phenyl]-2-[butan-2-yl(ethyl)amino]acetamide
CID 43274235
N-(2-amino-5-fluorophenyl)-2-[butan-2-yl(ethyl)amino]acetamide
CID 43611926
N-(2-amino-6-methylphenyl)-2-(2-methylphenyl)acetamide
CID 43152283
N-(2-amino-6-methylphenyl)-2-methoxyacetamide
CID 43376359

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-6-methylphenyl)-2-[butan-2-yl(ethyl)amino]acetamide?
The IUPAC name of N-(2-amino-6-methylphenyl)-2-[butan-2-yl(ethyl)amino]acetamide (CID 43376010) is N-(2-amino-6-methylphenyl)-2-[butan-2-yl(ethyl)amino]acetamide.
What is the SMILES notation for N-(2-amino-6-methylphenyl)-2-[butan-2-yl(ethyl)amino]acetamide?
The canonical SMILES for N-(2-amino-6-methylphenyl)-2-[butan-2-yl(ethyl)amino]acetamide is CCC(C)N(CC)CC(=O)Nc1c(C)cccc1N.
What is the InChIKey of N-(2-amino-6-methylphenyl)-2-[butan-2-yl(ethyl)amino]acetamide?
The InChIKey is INJQZLGHUUBBKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-5-12(4)18(6-2)10-14(19)17-15-11(3)8-7-9-13(15)16/h7-9,12H,5-6,10,16H2,1-4H3,(H,17,19).
What are the key properties of N-(2-amino-6-methylphenyl)-2-[butan-2-yl(ethyl)amino]acetamide?
N-(2-amino-6-methylphenyl)-2-[butan-2-yl(ethyl)amino]acetamide has a molecular weight of 263.38 g/mol, XLogP of 2.64, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-6-methylphenyl)-2-[butan-2-yl(ethyl)amino]acetamide is sourced from PubChem (CID 43376010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).