N-[2-(2-methoxyphenyl)ethyl]-2,2-dimethylpropanamide

C14H21NO2 — CID 15179102

IUPACN-[2-(2-methoxyphenyl)ethyl]-2,2-dimethylpropanamide
SMILESCOc1ccccc1CCNC(=O)C(C)(C)C
InChIInChI=1S/C14H21NO2/c1-14(2,3)13(16)15-10-9-11-7-5-6-8-12(11)17-4/h5-8H,9-10H2,1-4H3,(H,15,16)
InChIKeyPORZLKOCKCRLDM-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.40
Rot. Bonds4

About N-[2-(2-methoxyphenyl)ethyl]-2,2-dimethylpropanamide

N-[2-(2-methoxyphenyl)ethyl]-2,2-dimethylpropanamide (PubChem CID 15179102) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is N-[2-(2-methoxyphenyl)ethyl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[2-(2-methoxyphenyl)ethyl]-2,2-dimethylpropanamide
PubChem CID15179102
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC NameN-[2-(2-methoxyphenyl)ethyl]-2,2-dimethylpropanamide
SMILESCOc1ccccc1CCNC(=O)C(C)(C)C
InChIInChI=1S/C14H21NO2/c1-14(2,3)13(16)15-10-9-11-7-5-6-8-12(11)17-4/h5-8H,9-10H2,1-4H3,(H,15,16)
InChIKeyPORZLKOCKCRLDM-UHFFFAOYSA-N
XLogP2.40
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-[2-(2-methoxyphenyl)ethyl]-2,2,3-trimethylbutanamide
CID 106260825
2,2,3,3,3-pentafluoro-N-[2-(2-methoxyphenyl)ethyl]propanamide
CID 584158
N-butyl-N'-[2-(2-methoxyphenyl)ethyl]-2,2-dimethylpropanediamide
CID 108957803
2-(4-fluorophenyl)-N-[2-(2-methoxyphenyl)ethyl]-2-methylpropanamide
CID 113197369
N-[2-(4-fluorophenyl)ethyl]-N'-[2-(2-methoxyphenyl)ethyl]-2,2-dimethylpropanediamide
CID 108964149
N'-(2-methoxyethyl)-N-[2-(2-methoxyphenyl)ethyl]oxamide
CID 44996618
(2R)-2-amino-N-[2-(2-methoxyphenyl)ethyl]propanamide;hydrochloride
CID 119270019
N-[2-(2,2-dimethylpropanoylamino)ethyl]-2-methoxybenzamide
CID 108538118
2-[2-(2-methoxyphenyl)ethylamino]-2-methylpropanoic acid
CID 94687146
2-(2,5-dimethylpyrrol-1-yl)-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 110688799
2-(1H-indol-3-yl)-N-[2-(2-methoxyphenyl)ethyl]-2-methylpropanamide
CID 113208953
N-[2-(2-methoxyphenyl)ethyl]-2-methylsulfanylacetamide
CID 112766496

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyphenyl)ethyl]-2,2-dimethylpropanamide?
The IUPAC name of N-[2-(2-methoxyphenyl)ethyl]-2,2-dimethylpropanamide (CID 15179102) is N-[2-(2-methoxyphenyl)ethyl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[2-(2-methoxyphenyl)ethyl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[2-(2-methoxyphenyl)ethyl]-2,2-dimethylpropanamide is COc1ccccc1CCNC(=O)C(C)(C)C.
What is the InChIKey of N-[2-(2-methoxyphenyl)ethyl]-2,2-dimethylpropanamide?
The InChIKey is PORZLKOCKCRLDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-14(2,3)13(16)15-10-9-11-7-5-6-8-12(11)17-4/h5-8H,9-10H2,1-4H3,(H,15,16).
What are the key properties of N-[2-(2-methoxyphenyl)ethyl]-2,2-dimethylpropanamide?
N-[2-(2-methoxyphenyl)ethyl]-2,2-dimethylpropanamide has a molecular weight of 235.33 g/mol, XLogP of 2.40, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyphenyl)ethyl]-2,2-dimethylpropanamide is sourced from PubChem (CID 15179102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).