2-(oxolan-2-ylmethylamino)-2-(4-propoxyphenyl)acetamide

C16H24N2O3 — CID 62497281

IUPAC2-(oxolan-2-ylmethylamino)-2-(4-propoxyphenyl)acetamide
SMILESCCCOc1ccc(C(NCC2CCCO2)C(N)=O)cc1
InChIInChI=1S/C16H24N2O3/c1-2-9-20-13-7-5-12(6-8-13)15(16(17)19)18-11-14-4-3-10-21-14/h5-8,14-15,18H,2-4,9-11H2,1H3,(H2,17,19)
InChIKeyMKIZRWXVUOWFTJ-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.77
Rot. Bonds8

About 2-(oxolan-2-ylmethylamino)-2-(4-propoxyphenyl)acetamide

2-(oxolan-2-ylmethylamino)-2-(4-propoxyphenyl)acetamide (PubChem CID 62497281) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-(oxolan-2-ylmethylamino)-2-(4-propoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(oxolan-2-ylmethylamino)-2-(4-propoxyphenyl)acetamide
PubChem CID62497281
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-(oxolan-2-ylmethylamino)-2-(4-propoxyphenyl)acetamide
SMILESCCCOc1ccc(C(NCC2CCCO2)C(N)=O)cc1
InChIInChI=1S/C16H24N2O3/c1-2-9-20-13-7-5-12(6-8-13)15(16(17)19)18-11-14-4-3-10-21-14/h5-8,14-15,18H,2-4,9-11H2,1H3,(H2,17,19)
InChIKeyMKIZRWXVUOWFTJ-UHFFFAOYSA-N
XLogP1.77
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-fluorophenyl)-2-(oxolan-2-ylmethylamino)acetamide
CID 60710779
2-(oxolan-2-ylmethylamino)-1-(4-propoxyphenyl)ethanol
CID 82314086
2-(4-methoxy-3-methylphenyl)-2-(oxolan-2-ylmethylamino)acetamide
CID 62133911
2-(cyclopentylamino)-2-(4-propoxyphenyl)acetamide
CID 62495956
methyl 2-(oxolan-2-ylmethylamino)-2-(4-propan-2-ylphenyl)acetate
CID 60994062
2-(3-fluoro-4-hydroxyphenyl)-2-(oxolan-2-ylmethylamino)acetamide
CID 107686173
N-(oxolan-2-ylmethyl)-N'-(4-propoxyphenyl)oxamide
CID 2926686
2-(3-bromo-4-fluorophenyl)-2-(oxolan-2-ylmethylamino)acetamide
CID 54892069
4-oxo-N-(oxolan-2-ylmethyl)-4-(4-propoxyphenyl)butanamide
CID 78774490
3-(oxolan-2-yl)-1-(4-propoxyphenyl)propan-1-ol
CID 65162391
2-(4-methylphenyl)-2-(oxolan-2-ylmethylamino)acetic acid
CID 54889959
3-(4-butoxyphenyl)-N-(oxolan-2-ylmethyl)prop-2-enamide
CID 2792148

Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-2-ylmethylamino)-2-(4-propoxyphenyl)acetamide?
The IUPAC name of 2-(oxolan-2-ylmethylamino)-2-(4-propoxyphenyl)acetamide (CID 62497281) is 2-(oxolan-2-ylmethylamino)-2-(4-propoxyphenyl)acetamide.
What is the SMILES notation for 2-(oxolan-2-ylmethylamino)-2-(4-propoxyphenyl)acetamide?
The canonical SMILES for 2-(oxolan-2-ylmethylamino)-2-(4-propoxyphenyl)acetamide is CCCOc1ccc(C(NCC2CCCO2)C(N)=O)cc1.
What is the InChIKey of 2-(oxolan-2-ylmethylamino)-2-(4-propoxyphenyl)acetamide?
The InChIKey is MKIZRWXVUOWFTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-2-9-20-13-7-5-12(6-8-13)15(16(17)19)18-11-14-4-3-10-21-14/h5-8,14-15,18H,2-4,9-11H2,1H3,(H2,17,19).
What are the key properties of 2-(oxolan-2-ylmethylamino)-2-(4-propoxyphenyl)acetamide?
2-(oxolan-2-ylmethylamino)-2-(4-propoxyphenyl)acetamide has a molecular weight of 292.38 g/mol, XLogP of 1.77, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-2-ylmethylamino)-2-(4-propoxyphenyl)acetamide is sourced from PubChem (CID 62497281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).