2-(tert-butylamino)-N-[(2-methoxyphenyl)methyl]acetamide

C14H22N2O2 — CID 78907392

IUPAC2-(tert-butylamino)-N-[(2-methoxyphenyl)methyl]acetamide
SMILESCOc1ccccc1CNC(=O)CNC(C)(C)C
InChIInChI=1S/C14H22N2O2/c1-14(2,3)16-10-13(17)15-9-11-7-5-6-8-12(11)18-4/h5-8,16H,9-10H2,1-4H3,(H,15,17)
InChIKeyOOMNHXSCBKYLRQ-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.70
Rot. Bonds5

About 2-(tert-butylamino)-N-[(2-methoxyphenyl)methyl]acetamide

2-(tert-butylamino)-N-[(2-methoxyphenyl)methyl]acetamide (PubChem CID 78907392) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-(tert-butylamino)-N-[(2-methoxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(tert-butylamino)-N-[(2-methoxyphenyl)methyl]acetamide
PubChem CID78907392
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-(tert-butylamino)-N-[(2-methoxyphenyl)methyl]acetamide
SMILESCOc1ccccc1CNC(=O)CNC(C)(C)C
InChIInChI=1S/C14H22N2O2/c1-14(2,3)16-10-13(17)15-9-11-7-5-6-8-12(11)18-4/h5-8,16H,9-10H2,1-4H3,(H,15,17)
InChIKeyOOMNHXSCBKYLRQ-UHFFFAOYSA-N
XLogP1.70
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-anilino-N-[(2-methoxyphenyl)methyl]acetamide
CID 60646954
2-(tert-butylamino)-N-(naphthalen-1-ylmethyl)acetamide
CID 47185263
N-[(2-bromophenyl)methyl]-2-(tert-butylamino)acetamide
CID 112727459
ethyl N-[2-[(2-methoxyphenyl)methylamino]-2-oxoethyl]carbamate
CID 112992730
2-[(2-methoxyphenyl)methylamino]-N-[(2-methylphenyl)methyl]acetamide
CID 108996645
N-[(2-chlorophenyl)methyl]-2-[(2-methoxyphenyl)methylamino]acetamide
CID 108998011
2-[2,6-di(propan-2-yl)anilino]-N-[(2-methoxyphenyl)methyl]acetamide
CID 108998486
N-[(2-methoxyphenyl)methyl]-2-methyl-2-(methylamino)propanamide
CID 62834293
N-[(2-methoxyphenyl)methyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 2713308
2-(4-fluorophenyl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 808183
tert-butyl N-[(2-methoxyphenyl)methyl]carbamate;hydrochloride
CID 174676513
N-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide
CID 8901770

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)-N-[(2-methoxyphenyl)methyl]acetamide?
The IUPAC name of 2-(tert-butylamino)-N-[(2-methoxyphenyl)methyl]acetamide (CID 78907392) is 2-(tert-butylamino)-N-[(2-methoxyphenyl)methyl]acetamide.
What is the SMILES notation for 2-(tert-butylamino)-N-[(2-methoxyphenyl)methyl]acetamide?
The canonical SMILES for 2-(tert-butylamino)-N-[(2-methoxyphenyl)methyl]acetamide is COc1ccccc1CNC(=O)CNC(C)(C)C.
What is the InChIKey of 2-(tert-butylamino)-N-[(2-methoxyphenyl)methyl]acetamide?
The InChIKey is OOMNHXSCBKYLRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-14(2,3)16-10-13(17)15-9-11-7-5-6-8-12(11)18-4/h5-8,16H,9-10H2,1-4H3,(H,15,17).
What are the key properties of 2-(tert-butylamino)-N-[(2-methoxyphenyl)methyl]acetamide?
2-(tert-butylamino)-N-[(2-methoxyphenyl)methyl]acetamide has a molecular weight of 250.34 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylamino)-N-[(2-methoxyphenyl)methyl]acetamide is sourced from PubChem (CID 78907392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).