N-(2-methylbutan-2-yl)-2-[1-(2-methylphenyl)ethylamino]acetamide

C16H26N2O — CID 60674187

IUPACN-(2-methylbutan-2-yl)-2-[1-(2-methylphenyl)ethylamino]acetamide
SMILESCCC(C)(C)NC(=O)CNC(C)c1ccccc1C
InChIInChI=1S/C16H26N2O/c1-6-16(4,5)18-15(19)11-17-13(3)14-10-8-7-9-12(14)2/h7-10,13,17H,6,11H2,1-5H3,(H,18,19)
InChIKeyMVZJBKSWXVAZSK-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.95
Rot. Bonds6

About N-(2-methylbutan-2-yl)-2-[1-(2-methylphenyl)ethylamino]acetamide

N-(2-methylbutan-2-yl)-2-[1-(2-methylphenyl)ethylamino]acetamide (PubChem CID 60674187) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is N-(2-methylbutan-2-yl)-2-[1-(2-methylphenyl)ethylamino]acetamide.

Molecular Properties

Compound NameN-(2-methylbutan-2-yl)-2-[1-(2-methylphenyl)ethylamino]acetamide
PubChem CID60674187
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC NameN-(2-methylbutan-2-yl)-2-[1-(2-methylphenyl)ethylamino]acetamide
SMILESCCC(C)(C)NC(=O)CNC(C)c1ccccc1C
InChIInChI=1S/C16H26N2O/c1-6-16(4,5)18-15(19)11-17-13(3)14-10-8-7-9-12(14)2/h7-10,13,17H,6,11H2,1-5H3,(H,18,19)
InChIKeyMVZJBKSWXVAZSK-UHFFFAOYSA-N
XLogP2.95
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-N-(2-methylbutan-2-yl)acetamide
CID 54938162
N-(2-methylbutan-2-yl)-2-[[(1S)-1-thiophen-2-ylethyl]amino]acetamide
CID 81409137
tert-butyl 2-[1-(2-methylphenyl)ethylamino]acetate
CID 60679878
N-cycloheptyl-2-[[(1R)-1-(2-methylphenyl)ethyl]amino]acetamide
CID 81363494
2-[[(1S)-1-(3-chlorophenyl)ethyl]amino]-N-(2-methylbutan-2-yl)acetamide
CID 81371630
2-[1-(3-fluorophenyl)ethylamino]-N-(2-methylbutan-2-yl)acetamide
CID 60674328
2-[[(1S)-1-(2-methylphenyl)ethyl]amino]-1-pyrrolidin-1-ylethanone
CID 81375206
N-tert-butyl-2-(1-naphthalen-1-ylethylamino)acetamide
CID 78913257
N-(2-methoxyethyl)-2-[1-(2-methylphenyl)ethylamino]acetamide
CID 60641541
3-methyl-3-[1-(2-methylphenyl)ethylcarbamoylamino]butanoic acid
CID 64702247
2-[[(1R)-1-(2-methylphenyl)ethyl]amino]-1-morpholin-4-ylethanone
CID 81374136
N-tert-butyl-2-[[(1S)-1-phenylethyl]amino]acetamide
CID 28564730

Frequently Asked Questions

What is the IUPAC name of N-(2-methylbutan-2-yl)-2-[1-(2-methylphenyl)ethylamino]acetamide?
The IUPAC name of N-(2-methylbutan-2-yl)-2-[1-(2-methylphenyl)ethylamino]acetamide (CID 60674187) is N-(2-methylbutan-2-yl)-2-[1-(2-methylphenyl)ethylamino]acetamide.
What is the SMILES notation for N-(2-methylbutan-2-yl)-2-[1-(2-methylphenyl)ethylamino]acetamide?
The canonical SMILES for N-(2-methylbutan-2-yl)-2-[1-(2-methylphenyl)ethylamino]acetamide is CCC(C)(C)NC(=O)CNC(C)c1ccccc1C.
What is the InChIKey of N-(2-methylbutan-2-yl)-2-[1-(2-methylphenyl)ethylamino]acetamide?
The InChIKey is MVZJBKSWXVAZSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-6-16(4,5)18-15(19)11-17-13(3)14-10-8-7-9-12(14)2/h7-10,13,17H,6,11H2,1-5H3,(H,18,19).
What are the key properties of N-(2-methylbutan-2-yl)-2-[1-(2-methylphenyl)ethylamino]acetamide?
N-(2-methylbutan-2-yl)-2-[1-(2-methylphenyl)ethylamino]acetamide has a molecular weight of 262.40 g/mol, XLogP of 2.95, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylbutan-2-yl)-2-[1-(2-methylphenyl)ethylamino]acetamide is sourced from PubChem (CID 60674187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).