N-(2-methylpropyl)-2-[(2-propan-2-yloxyphenyl)methylamino]acetamide

C16H26N2O2 — CID 115621831

IUPACN-(2-methylpropyl)-2-[(2-propan-2-yloxyphenyl)methylamino]acetamide
SMILESCC(C)CNC(=O)CNCc1ccccc1OC(C)C
InChIInChI=1S/C16H26N2O2/c1-12(2)9-18-16(19)11-17-10-14-7-5-6-8-15(14)20-13(3)4/h5-8,12-13,17H,9-11H2,1-4H3,(H,18,19)
InChIKeyLVXJYSATAAHCAJ-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.34
Rot. Bonds8

About N-(2-methylpropyl)-2-[(2-propan-2-yloxyphenyl)methylamino]acetamide

N-(2-methylpropyl)-2-[(2-propan-2-yloxyphenyl)methylamino]acetamide (PubChem CID 115621831) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-[(2-propan-2-yloxyphenyl)methylamino]acetamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-[(2-propan-2-yloxyphenyl)methylamino]acetamide
PubChem CID115621831
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC NameN-(2-methylpropyl)-2-[(2-propan-2-yloxyphenyl)methylamino]acetamide
SMILESCC(C)CNC(=O)CNCc1ccccc1OC(C)C
InChIInChI=1S/C16H26N2O2/c1-12(2)9-18-16(19)11-17-10-14-7-5-6-8-15(14)20-13(3)4/h5-8,12-13,17H,9-11H2,1-4H3,(H,18,19)
InChIKeyLVXJYSATAAHCAJ-UHFFFAOYSA-N
XLogP2.34
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-ethoxyphenyl)methylamino]-N-(2-methylpropyl)acetamide
CID 112690620
2-[(2-methylphenyl)methylamino]-N-(2-methylpropyl)acetamide
CID 60695447
(2S)-1-[(2-propan-2-yloxyphenyl)methylamino]propan-2-ol
CID 51675528
2-methyl-N-[(2-propan-2-yloxyphenyl)methyl]prop-2-en-1-amine
CID 114615444
(2S)-2-amino-N-[(2-propan-2-yloxyphenyl)methyl]propanamide
CID 83294447
2-[2-(methylaminomethyl)phenoxy]-N-(2-methylpropyl)propanamide
CID 43277159
N-carbamoyl-2-[2-[(2-methylpropylamino)methyl]phenoxy]propanamide
CID 63062222
N-methyl-N'-[(2-propan-2-yloxyphenyl)methyl]oxamide
CID 125144882
2-[(2-propan-2-yloxyphenyl)methylamino]propanoic acid
CID 54959628
2-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-amine
CID 43221119
2-(2-hydroxyphenyl)-N-(2-methylpropyl)acetamide
CID 22947307
3-methylsulfonyl-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-amine
CID 54904730

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-[(2-propan-2-yloxyphenyl)methylamino]acetamide?
The IUPAC name of N-(2-methylpropyl)-2-[(2-propan-2-yloxyphenyl)methylamino]acetamide (CID 115621831) is N-(2-methylpropyl)-2-[(2-propan-2-yloxyphenyl)methylamino]acetamide.
What is the SMILES notation for N-(2-methylpropyl)-2-[(2-propan-2-yloxyphenyl)methylamino]acetamide?
The canonical SMILES for N-(2-methylpropyl)-2-[(2-propan-2-yloxyphenyl)methylamino]acetamide is CC(C)CNC(=O)CNCc1ccccc1OC(C)C.
What is the InChIKey of N-(2-methylpropyl)-2-[(2-propan-2-yloxyphenyl)methylamino]acetamide?
The InChIKey is LVXJYSATAAHCAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-12(2)9-18-16(19)11-17-10-14-7-5-6-8-15(14)20-13(3)4/h5-8,12-13,17H,9-11H2,1-4H3,(H,18,19).
What are the key properties of N-(2-methylpropyl)-2-[(2-propan-2-yloxyphenyl)methylamino]acetamide?
N-(2-methylpropyl)-2-[(2-propan-2-yloxyphenyl)methylamino]acetamide has a molecular weight of 278.40 g/mol, XLogP of 2.34, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-[(2-propan-2-yloxyphenyl)methylamino]acetamide is sourced from PubChem (CID 115621831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).