3-(2-methoxyphenyl)-N-methyl-N-[2-[(2R)-oxolan-2-yl]ethyl]propanamide

C17H25NO3 — CID 99790252

IUPAC3-(2-methoxyphenyl)-N-methyl-N-[2-[(2R)-oxolan-2-yl]ethyl]propanamide
SMILESCOc1ccccc1CCC(=O)N(C)CC[C@H]1CCCO1
InChIInChI=1S/C17H25NO3/c1-18(12-11-15-7-5-13-21-15)17(19)10-9-14-6-3-4-8-16(14)20-2/h3-4,6,8,15H,5,7,9-13H2,1-2H3/t15-/m1/s1
InChIKeyOTQRWHFKCJKYLC-OAHLLOKOSA-N
MW291.39 g/mol
LogP2.66
Rot. Bonds7

About 3-(2-methoxyphenyl)-N-methyl-N-[2-[(2R)-oxolan-2-yl]ethyl]propanamide

3-(2-methoxyphenyl)-N-methyl-N-[2-[(2R)-oxolan-2-yl]ethyl]propanamide (PubChem CID 99790252) has the molecular formula C17H25NO3 and a molecular weight of 291.39 g/mol. Its IUPAC name is 3-(2-methoxyphenyl)-N-methyl-N-[2-[(2R)-oxolan-2-yl]ethyl]propanamide.

Molecular Properties

Compound Name3-(2-methoxyphenyl)-N-methyl-N-[2-[(2R)-oxolan-2-yl]ethyl]propanamide
PubChem CID99790252
Molecular FormulaC17H25NO3
Molecular Weight291.39 g/mol
Exact Mass291.18
IUPAC Name3-(2-methoxyphenyl)-N-methyl-N-[2-[(2R)-oxolan-2-yl]ethyl]propanamide
SMILESCOc1ccccc1CCC(=O)N(C)CC[C@H]1CCCO1
InChIInChI=1S/C17H25NO3/c1-18(12-11-15-7-5-13-21-15)17(19)10-9-14-6-3-4-8-16(14)20-2/h3-4,6,8,15H,5,7,9-13H2,1-2H3/t15-/m1/s1
InChIKeyOTQRWHFKCJKYLC-OAHLLOKOSA-N
XLogP2.66
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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3-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)propanamide
CID 55968507
methyl 4-[3-(2-methoxyphenyl)propanoyl-methylamino]butanoate
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3-(3-hydroxyphenyl)-N-methyl-N-[2-(oxan-2-yl)ethyl]propanamide
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N-[(2-methoxyphenyl)methyl]-1-[(2S)-oxolan-2-yl]methanamine
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N-[[2-(dimethylamino)-5,8-dimethoxyquinolin-3-yl]methyl]-3-(2-methoxyphenyl)-N-[[(2R)-oxolan-2-yl]methyl]propanamide
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1-[(2S)-2-[(2-methoxyphenyl)methyl]pyrrolidin-1-yl]-3-[(2R)-oxolan-2-yl]propan-1-one
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2-(cyclopropylmethylamino)-N-[(2-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)acetamide
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N'-[(2-methoxyphenyl)methyl]-N-(oxolan-2-ylmethyl)propanediamide
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N-[(2-methoxyphenyl)methyl]-N-methyl-3-(oxolan-2-ylmethoxy)benzamide
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Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenyl)-N-methyl-N-[2-[(2R)-oxolan-2-yl]ethyl]propanamide?
The IUPAC name of 3-(2-methoxyphenyl)-N-methyl-N-[2-[(2R)-oxolan-2-yl]ethyl]propanamide (CID 99790252) is 3-(2-methoxyphenyl)-N-methyl-N-[2-[(2R)-oxolan-2-yl]ethyl]propanamide.
What is the SMILES notation for 3-(2-methoxyphenyl)-N-methyl-N-[2-[(2R)-oxolan-2-yl]ethyl]propanamide?
The canonical SMILES for 3-(2-methoxyphenyl)-N-methyl-N-[2-[(2R)-oxolan-2-yl]ethyl]propanamide is COc1ccccc1CCC(=O)N(C)CC[C@H]1CCCO1.
What is the InChIKey of 3-(2-methoxyphenyl)-N-methyl-N-[2-[(2R)-oxolan-2-yl]ethyl]propanamide?
The InChIKey is OTQRWHFKCJKYLC-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H25NO3/c1-18(12-11-15-7-5-13-21-15)17(19)10-9-14-6-3-4-8-16(14)20-2/h3-4,6,8,15H,5,7,9-13H2,1-2H3/t15-/m1/s1.
What are the key properties of 3-(2-methoxyphenyl)-N-methyl-N-[2-[(2R)-oxolan-2-yl]ethyl]propanamide?
3-(2-methoxyphenyl)-N-methyl-N-[2-[(2R)-oxolan-2-yl]ethyl]propanamide has a molecular weight of 291.39 g/mol, XLogP of 2.66, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenyl)-N-methyl-N-[2-[(2R)-oxolan-2-yl]ethyl]propanamide is sourced from PubChem (CID 99790252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).