(2R)-N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]-2-(oxan-4-yl)propanamide

C19H29NO3 — CID 97244143

IUPAC(2R)-N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]-2-(oxan-4-yl)propanamide
SMILESCOc1cccc(CC(C)(C)NC(=O)[C@H](C)C2CCOCC2)c1
InChIInChI=1S/C19H29NO3/c1-14(16-8-10-23-11-9-16)18(21)20-19(2,3)13-15-6-5-7-17(12-15)22-4/h5-7,12,14,16H,8-11,13H2,1-4H3,(H,20,21)/t14-/m1/s1
InChIKeyDWTQTHFXQSPVDG-CQSZACIVSA-N
MW319.44 g/mol
LogP3.20
Rot. Bonds6

About (2R)-N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]-2-(oxan-4-yl)propanamide

(2R)-N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]-2-(oxan-4-yl)propanamide (PubChem CID 97244143) has the molecular formula C19H29NO3 and a molecular weight of 319.44 g/mol. Its IUPAC name is (2R)-N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]-2-(oxan-4-yl)propanamide.

Molecular Properties

Compound Name(2R)-N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]-2-(oxan-4-yl)propanamide
PubChem CID97244143
Molecular FormulaC19H29NO3
Molecular Weight319.44 g/mol
Exact Mass319.21
IUPAC Name(2R)-N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]-2-(oxan-4-yl)propanamide
SMILESCOc1cccc(CC(C)(C)NC(=O)[C@H](C)C2CCOCC2)c1
InChIInChI=1S/C19H29NO3/c1-14(16-8-10-23-11-9-16)18(21)20-19(2,3)13-15-6-5-7-17(12-15)22-4/h5-7,12,14,16H,8-11,13H2,1-4H3,(H,20,21)/t14-/m1/s1
InChIKeyDWTQTHFXQSPVDG-CQSZACIVSA-N
XLogP3.20
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.44
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[1-(3-methoxyphenyl)propan-2-yl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120793315
2-cyclopentyl-N-[2-(3-methoxyphenyl)ethyl]propanamide
CID 110355667
2-chloro-N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]acetamide
CID 94691468
N-[(4-methoxy-2-methylphenyl)methyl]-2-(oxan-4-yl)propanamide
CID 75433024
N-(4-methoxyphenyl)-2-(oxan-4-yl)propanamide
CID 110876397
1-(3-methoxyphenyl)-2-propan-2-yloxypropan-2-ol
CID 91379820
1-(3-methoxyphenyl)-N,2-dimethylpropan-2-amine
CID 82125732
2-amino-1-[4-[2-(3-methoxyphenyl)acetyl]piperazin-1-yl]-2-(oxan-4-yl)ethanone;hydrochloride
CID 120790303
N-[(2-tert-butyloxolan-3-yl)methyl]-2-[(3-methoxyphenyl)methoxy]propanamide
CID 56791697
N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]formamide
CID 121002353
2-(3-methoxyanilino)-2-(oxan-4-yl)ethanol
CID 62392316
2-methyl-2-[2-(oxan-4-yl)propanoylamino]butanoic acid
CID 120686254

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]-2-(oxan-4-yl)propanamide?
The IUPAC name of (2R)-N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]-2-(oxan-4-yl)propanamide (CID 97244143) is (2R)-N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]-2-(oxan-4-yl)propanamide.
What is the SMILES notation for (2R)-N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]-2-(oxan-4-yl)propanamide?
The canonical SMILES for (2R)-N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]-2-(oxan-4-yl)propanamide is COc1cccc(CC(C)(C)NC(=O)[C@H](C)C2CCOCC2)c1.
What is the InChIKey of (2R)-N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]-2-(oxan-4-yl)propanamide?
The InChIKey is DWTQTHFXQSPVDG-CQSZACIVSA-N. The full InChI is InChI=1S/C19H29NO3/c1-14(16-8-10-23-11-9-16)18(21)20-19(2,3)13-15-6-5-7-17(12-15)22-4/h5-7,12,14,16H,8-11,13H2,1-4H3,(H,20,21)/t14-/m1/s1.
What are the key properties of (2R)-N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]-2-(oxan-4-yl)propanamide?
(2R)-N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]-2-(oxan-4-yl)propanamide has a molecular weight of 319.44 g/mol, XLogP of 3.20, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[1-(3-methoxyphenyl)-2-methylpropan-2-yl]-2-(oxan-4-yl)propanamide is sourced from PubChem (CID 97244143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).