2-(oxolan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)acetamide

C16H24N2O3 — CID 54815711

IUPAC2-(oxolan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)acetamide
SMILESCC(C)Oc1ccccc1NC(=O)CNCC1CCCO1
InChIInChI=1S/C16H24N2O3/c1-12(2)21-15-8-4-3-7-14(15)18-16(19)11-17-10-13-6-5-9-20-13/h3-4,7-8,12-13,17H,5-6,9-11H2,1-2H3,(H,18,19)
InChIKeyQXXKSVDUQJQWOV-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.18
Rot. Bonds7

About 2-(oxolan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)acetamide

2-(oxolan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)acetamide (PubChem CID 54815711) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-(oxolan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)acetamide.

Molecular Properties

Compound Name2-(oxolan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)acetamide
PubChem CID54815711
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-(oxolan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)acetamide
SMILESCC(C)Oc1ccccc1NC(=O)CNCC1CCCO1
InChIInChI=1S/C16H24N2O3/c1-12(2)21-15-8-4-3-7-14(15)18-16(19)11-17-10-13-6-5-9-20-13/h3-4,7-8,12-13,17H,5-6,9-11H2,1-2H3,(H,18,19)
InChIKeyQXXKSVDUQJQWOV-UHFFFAOYSA-N
XLogP2.18
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(oxolan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)propanamide
CID 109016102
2-(oxan-2-yl)-N-(2-propan-2-yloxyphenyl)acetamide
CID 110422651
N-(oxolan-2-ylmethyl)-2-(2-propan-2-yloxyanilino)acetamide
CID 54828739
2-[4-(oxolan-2-ylmethoxy)anilino]-N-(2-propan-2-yloxyphenyl)acetamide
CID 54821459
N-(2,3-dimethylphenyl)-2-[[(2R)-oxolan-2-yl]methylamino]acetamide
CID 2078790
1-N-(oxolan-2-ylmethyl)-1-N'-(2-propan-2-yloxyphenyl)cyclopropane-1,1-dicarboxamide
CID 108973334
(2S)-2-[[(2S)-oxolan-2-yl]methoxy]-N-(2-propan-2-yloxyphenyl)propanamide
CID 94823131
(2S)-2-[[(2R)-oxolan-2-yl]methoxy]-N-(2-propan-2-yloxyphenyl)propanamide
CID 94823133
N-(3-cyclopentyloxy-2-methylphenyl)-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride
CID 91645589
N-(2-cyanophenyl)-2-[[(2R)-oxolan-2-yl]methylamino]acetamide
CID 1439761
2-(oxolan-2-ylmethylamino)-N-(2-pyrrol-1-ylphenyl)acetamide
CID 645953
N-[2-(difluoromethylsulfanyl)phenyl]-2-(oxolan-2-ylmethylamino)acetamide;hydrochloride
CID 119687133

Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)acetamide?
The IUPAC name of 2-(oxolan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)acetamide (CID 54815711) is 2-(oxolan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)acetamide.
What is the SMILES notation for 2-(oxolan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)acetamide?
The canonical SMILES for 2-(oxolan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)acetamide is CC(C)Oc1ccccc1NC(=O)CNCC1CCCO1.
What is the InChIKey of 2-(oxolan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)acetamide?
The InChIKey is QXXKSVDUQJQWOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-12(2)21-15-8-4-3-7-14(15)18-16(19)11-17-10-13-6-5-9-20-13/h3-4,7-8,12-13,17H,5-6,9-11H2,1-2H3,(H,18,19).
What are the key properties of 2-(oxolan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)acetamide?
2-(oxolan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)acetamide has a molecular weight of 292.38 g/mol, XLogP of 2.18, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)acetamide is sourced from PubChem (CID 54815711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).