N-ethyl-2-[2-methyl-6-[(propan-2-ylamino)methyl]phenoxy]acetamide

C15H24N2O2 — CID 112610064

IUPACN-ethyl-2-[2-methyl-6-[(propan-2-ylamino)methyl]phenoxy]acetamide
SMILESCCNC(=O)COc1c(C)cccc1CNC(C)C
InChIInChI=1S/C15H24N2O2/c1-5-16-14(18)10-19-15-12(4)7-6-8-13(15)9-17-11(2)3/h6-8,11,17H,5,9-10H2,1-4H3,(H,16,18)
InChIKeyZOVVJKAHTAOAPC-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.01
Rot. Bonds7

About N-ethyl-2-[2-methyl-6-[(propan-2-ylamino)methyl]phenoxy]acetamide

N-ethyl-2-[2-methyl-6-[(propan-2-ylamino)methyl]phenoxy]acetamide (PubChem CID 112610064) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-ethyl-2-[2-methyl-6-[(propan-2-ylamino)methyl]phenoxy]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[2-methyl-6-[(propan-2-ylamino)methyl]phenoxy]acetamide
PubChem CID112610064
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-ethyl-2-[2-methyl-6-[(propan-2-ylamino)methyl]phenoxy]acetamide
SMILESCCNC(=O)COc1c(C)cccc1CNC(C)C
InChIInChI=1S/C15H24N2O2/c1-5-16-14(18)10-19-15-12(4)7-6-8-13(15)9-17-11(2)3/h6-8,11,17H,5,9-10H2,1-4H3,(H,16,18)
InChIKeyZOVVJKAHTAOAPC-UHFFFAOYSA-N
XLogP2.01
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-fluoro-6-[(propan-2-ylamino)methyl]phenoxy]-N-(2-methylpropyl)acetamide
CID 115955069
2-[2-methyl-6-(propylaminomethyl)phenoxy]-N-propan-2-ylacetamide
CID 115952813
2-[[2-(2,6-dimethylphenoxy)acetyl]amino]-N-ethylpropanamide
CID 47112988
2-[2-chloro-6-[(propan-2-ylamino)methyl]phenoxy]-N-prop-2-ynylacetamide
CID 115954513
N-[[2-(methoxymethoxy)-3-methylphenyl]methyl]propan-2-amine
CID 112610137
2-[4-chloro-2-methoxy-6-[(propan-2-ylamino)methyl]phenoxy]-N-ethylacetamide
CID 104664912
N-[(2-heptoxy-3-methylphenyl)methyl]propan-2-amine
CID 115954021
2-[2-methyl-6-(methylaminomethyl)phenoxy]-N-prop-2-ynylacetamide
CID 112608234
N-[[2-(3,3-dimethylbutoxy)-3-methylphenyl]methyl]propan-2-amine
CID 112610090
1-methoxy-3-[2-methyl-6-[(propan-2-ylamino)methyl]phenoxy]propan-2-ol
CID 112610151
2-[2-(ethylaminomethyl)-6-methylphenoxy]-N-methyl-N-propan-2-ylacetamide
CID 115952627
2-[2-chloro-6-[(propan-2-ylamino)methyl]phenoxy]-N-(2-cyanoethyl)acetamide
CID 115954541

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[2-methyl-6-[(propan-2-ylamino)methyl]phenoxy]acetamide?
The IUPAC name of N-ethyl-2-[2-methyl-6-[(propan-2-ylamino)methyl]phenoxy]acetamide (CID 112610064) is N-ethyl-2-[2-methyl-6-[(propan-2-ylamino)methyl]phenoxy]acetamide.
What is the SMILES notation for N-ethyl-2-[2-methyl-6-[(propan-2-ylamino)methyl]phenoxy]acetamide?
The canonical SMILES for N-ethyl-2-[2-methyl-6-[(propan-2-ylamino)methyl]phenoxy]acetamide is CCNC(=O)COc1c(C)cccc1CNC(C)C.
What is the InChIKey of N-ethyl-2-[2-methyl-6-[(propan-2-ylamino)methyl]phenoxy]acetamide?
The InChIKey is ZOVVJKAHTAOAPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-5-16-14(18)10-19-15-12(4)7-6-8-13(15)9-17-11(2)3/h6-8,11,17H,5,9-10H2,1-4H3,(H,16,18).
What are the key properties of N-ethyl-2-[2-methyl-6-[(propan-2-ylamino)methyl]phenoxy]acetamide?
N-ethyl-2-[2-methyl-6-[(propan-2-ylamino)methyl]phenoxy]acetamide has a molecular weight of 264.37 g/mol, XLogP of 2.01, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[2-methyl-6-[(propan-2-ylamino)methyl]phenoxy]acetamide is sourced from PubChem (CID 112610064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).