2-[1-(4-methoxyphenyl)ethylamino]-N-(oxan-4-yl)acetamide

C16H24N2O3 — CID 66244703

IUPAC2-[1-(4-methoxyphenyl)ethylamino]-N-(oxan-4-yl)acetamide
SMILESCOc1ccc(C(C)NCC(=O)NC2CCOCC2)cc1
InChIInChI=1S/C16H24N2O3/c1-12(13-3-5-15(20-2)6-4-13)17-11-16(19)18-14-7-9-21-10-8-14/h3-6,12,14,17H,7-11H2,1-2H3,(H,18,19)
InChIKeyCQBLHRBQRMHYJK-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.64
Rot. Bonds6

About 2-[1-(4-methoxyphenyl)ethylamino]-N-(oxan-4-yl)acetamide

2-[1-(4-methoxyphenyl)ethylamino]-N-(oxan-4-yl)acetamide (PubChem CID 66244703) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-[1-(4-methoxyphenyl)ethylamino]-N-(oxan-4-yl)acetamide.

Molecular Properties

Compound Name2-[1-(4-methoxyphenyl)ethylamino]-N-(oxan-4-yl)acetamide
PubChem CID66244703
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-[1-(4-methoxyphenyl)ethylamino]-N-(oxan-4-yl)acetamide
SMILESCOc1ccc(C(C)NCC(=O)NC2CCOCC2)cc1
InChIInChI=1S/C16H24N2O3/c1-12(13-3-5-15(20-2)6-4-13)17-11-16(19)18-14-7-9-21-10-8-14/h3-6,12,14,17H,7-11H2,1-2H3,(H,18,19)
InChIKeyCQBLHRBQRMHYJK-UHFFFAOYSA-N
XLogP1.64
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[(1R)-1-(3-methylphenyl)ethyl]amino]-N-(oxan-4-yl)acetamide
CID 81361124
2-[1-(3-chlorophenyl)ethylamino]-N-(oxan-4-yl)acetamide
CID 63098158
2-[[(1S)-1-(4-methoxyphenyl)ethyl]amino]-N-methylacetamide
CID 81371329
2-[1-(4-bromophenyl)ethylamino]-N-cyclopropylacetamide
CID 43398074
2-[1-(furan-2-yl)ethylamino]-N-(oxan-4-yl)acetamide
CID 55182265
2-[1-(4-tert-butylphenyl)ethylamino]-N-cyclopropylacetamide
CID 43568343
N-cyclopropyl-2-[1-[4-(2-methylpropyl)phenyl]ethylamino]acetamide
CID 43398065
2-[[(1R)-1-(4-bromophenyl)ethyl]amino]-N-cyclopentylacetamide
CID 81359637
N-cyclopropyl-2-[1-(3-fluoro-4-methoxyphenyl)ethylamino]acetamide
CID 43401121
2-[[(1S)-1-(4-bromophenyl)ethyl]amino]-N-cyclohexylacetamide
CID 81359177
2-(3-methylbutan-2-ylamino)-N-(oxan-4-yl)acetamide
CID 63098151
N-cycloheptyl-2-[[(1S)-1-phenylethyl]amino]acetamide
CID 63867372

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-methoxyphenyl)ethylamino]-N-(oxan-4-yl)acetamide?
The IUPAC name of 2-[1-(4-methoxyphenyl)ethylamino]-N-(oxan-4-yl)acetamide (CID 66244703) is 2-[1-(4-methoxyphenyl)ethylamino]-N-(oxan-4-yl)acetamide.
What is the SMILES notation for 2-[1-(4-methoxyphenyl)ethylamino]-N-(oxan-4-yl)acetamide?
The canonical SMILES for 2-[1-(4-methoxyphenyl)ethylamino]-N-(oxan-4-yl)acetamide is COc1ccc(C(C)NCC(=O)NC2CCOCC2)cc1.
What is the InChIKey of 2-[1-(4-methoxyphenyl)ethylamino]-N-(oxan-4-yl)acetamide?
The InChIKey is CQBLHRBQRMHYJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-12(13-3-5-15(20-2)6-4-13)17-11-16(19)18-14-7-9-21-10-8-14/h3-6,12,14,17H,7-11H2,1-2H3,(H,18,19).
What are the key properties of 2-[1-(4-methoxyphenyl)ethylamino]-N-(oxan-4-yl)acetamide?
2-[1-(4-methoxyphenyl)ethylamino]-N-(oxan-4-yl)acetamide has a molecular weight of 292.38 g/mol, XLogP of 1.64, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-methoxyphenyl)ethylamino]-N-(oxan-4-yl)acetamide is sourced from PubChem (CID 66244703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).