(2R)-2-(2-methylphenoxy)-N-(1-propylpiperidin-4-yl)propanamide

C18H28N2O2 — CID 27233966

IUPAC(2R)-2-(2-methylphenoxy)-N-(1-propylpiperidin-4-yl)propanamide
SMILESCCCN1CCC(NC(=O)[C@@H](C)Oc2ccccc2C)CC1
InChIInChI=1S/C18H28N2O2/c1-4-11-20-12-9-16(10-13-20)19-18(21)15(3)22-17-8-6-5-7-14(17)2/h5-8,15-16H,4,9-13H2,1-3H3,(H,19,21)/t15-/m1/s1
InChIKeyOFZFOBWUVFDTTG-OAHLLOKOSA-N
MW304.43 g/mol
LogP2.75
Rot. Bonds6

About (2R)-2-(2-methylphenoxy)-N-(1-propylpiperidin-4-yl)propanamide

(2R)-2-(2-methylphenoxy)-N-(1-propylpiperidin-4-yl)propanamide (PubChem CID 27233966) has the molecular formula C18H28N2O2 and a molecular weight of 304.43 g/mol. Its IUPAC name is (2R)-2-(2-methylphenoxy)-N-(1-propylpiperidin-4-yl)propanamide.

Molecular Properties

Compound Name(2R)-2-(2-methylphenoxy)-N-(1-propylpiperidin-4-yl)propanamide
PubChem CID27233966
Molecular FormulaC18H28N2O2
Molecular Weight304.43 g/mol
Exact Mass304.22
IUPAC Name(2R)-2-(2-methylphenoxy)-N-(1-propylpiperidin-4-yl)propanamide
SMILESCCCN1CCC(NC(=O)[C@@H](C)Oc2ccccc2C)CC1
InChIInChI=1S/C18H28N2O2/c1-4-11-20-12-9-16(10-13-20)19-18(21)15(3)22-17-8-6-5-7-14(17)2/h5-8,15-16H,4,9-13H2,1-3H3,(H,19,21)/t15-/m1/s1
InChIKeyOFZFOBWUVFDTTG-OAHLLOKOSA-N
XLogP2.75
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.43
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-bromophenoxy)-N-(1-propylpiperidin-4-yl)propanamide
CID 17250210
(2S)-2-(2-methylphenoxy)-N-(1-methylpiperidin-4-yl)propanamide
CID 27232779
(2R)-N-(1-benzylpiperidin-4-yl)-2-(2-methylphenoxy)propanamide
CID 27233294
(2S)-2-(4-methylphenoxy)-N-(1-propylpiperidin-4-yl)propanamide
CID 27211856
(2S)-2-(2-chloro-5-methylphenoxy)-N-(1-propylpiperidin-4-yl)propanamide
CID 27232531
(2S)-N-cyclooctyl-2-(2-methylphenoxy)propanamide
CID 94842700
(2S)-2-(2-chloro-4-fluorophenoxy)-N-(1-propylpiperidin-4-yl)propanamide
CID 27212161
2-(2-chloro-4-fluorophenoxy)-N-(1-propylpiperidin-4-yl)propanamide
CID 17250206
ethyl 4-[2-(2-propan-2-ylphenoxy)propanoylamino]piperidine-1-carboxylate
CID 108560850
2-(3-bromophenoxy)-N-(1-propylpiperidin-4-yl)propanamide
CID 17250209
(2R)-N-cyclopropyl-2-(2,3-dimethylphenoxy)propanamide
CID 39717598
1-(2-ethoxyphenyl)-3-(1-propylpiperidin-4-yl)urea
CID 6468357

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-methylphenoxy)-N-(1-propylpiperidin-4-yl)propanamide?
The IUPAC name of (2R)-2-(2-methylphenoxy)-N-(1-propylpiperidin-4-yl)propanamide (CID 27233966) is (2R)-2-(2-methylphenoxy)-N-(1-propylpiperidin-4-yl)propanamide.
What is the SMILES notation for (2R)-2-(2-methylphenoxy)-N-(1-propylpiperidin-4-yl)propanamide?
The canonical SMILES for (2R)-2-(2-methylphenoxy)-N-(1-propylpiperidin-4-yl)propanamide is CCCN1CCC(NC(=O)[C@@H](C)Oc2ccccc2C)CC1.
What is the InChIKey of (2R)-2-(2-methylphenoxy)-N-(1-propylpiperidin-4-yl)propanamide?
The InChIKey is OFZFOBWUVFDTTG-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H28N2O2/c1-4-11-20-12-9-16(10-13-20)19-18(21)15(3)22-17-8-6-5-7-14(17)2/h5-8,15-16H,4,9-13H2,1-3H3,(H,19,21)/t15-/m1/s1.
What are the key properties of (2R)-2-(2-methylphenoxy)-N-(1-propylpiperidin-4-yl)propanamide?
(2R)-2-(2-methylphenoxy)-N-(1-propylpiperidin-4-yl)propanamide has a molecular weight of 304.43 g/mol, XLogP of 2.75, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-methylphenoxy)-N-(1-propylpiperidin-4-yl)propanamide is sourced from PubChem (CID 27233966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).