(2R)-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-(3-methylphenoxy)propanamide

C18H28N2O2 — CID 94109673

IUPAC(2R)-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-(3-methylphenoxy)propanamide
SMILESCc1cccc(O[C@H](C)C(=O)NCC2(N(C)C)CCCC2)c1
InChIInChI=1S/C18H28N2O2/c1-14-8-7-9-16(12-14)22-15(2)17(21)19-13-18(20(3)4)10-5-6-11-18/h7-9,12,15H,5-6,10-11,13H2,1-4H3,(H,19,21)/t15-/m1/s1
InChIKeyKYVWGXWWQNPGNL-OAHLLOKOSA-N
MW304.43 g/mol
LogP2.75
Rot. Bonds6

About (2R)-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-(3-methylphenoxy)propanamide

(2R)-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-(3-methylphenoxy)propanamide (PubChem CID 94109673) has the molecular formula C18H28N2O2 and a molecular weight of 304.43 g/mol. Its IUPAC name is (2R)-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-(3-methylphenoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-(3-methylphenoxy)propanamide
PubChem CID94109673
Molecular FormulaC18H28N2O2
Molecular Weight304.43 g/mol
Exact Mass304.22
IUPAC Name(2R)-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-(3-methylphenoxy)propanamide
SMILESCc1cccc(O[C@H](C)C(=O)NCC2(N(C)C)CCCC2)c1
InChIInChI=1S/C18H28N2O2/c1-14-8-7-9-16(12-14)22-15(2)17(21)19-13-18(20(3)4)10-5-6-11-18/h7-9,12,15H,5-6,10-11,13H2,1-4H3,(H,19,21)/t15-/m1/s1
InChIKeyKYVWGXWWQNPGNL-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

(2R)-2-(4-chloro-3,5-dimethylphenoxy)-N-[[1-(dimethylamino)cyclohexyl]methyl]propanamide
CID 34950856
N-[2-(ethylamino)ethyl]-2-(3-methylphenoxy)propanamide
CID 119504615
N-[[1-(dimethylamino)cyclobutyl]methyl]-2-methoxypropanamide
CID 105420622
N-(2-amino-2-methylpropyl)-2-(3-methylphenoxy)propanamide
CID 119625770
(2R)-2-(3-methylphenoxy)-N-(3-methylphenyl)propanamide
CID 7946484
2-(3-methylphenoxy)-N-(3-methylphenyl)propanamide
CID 4931056
N-[2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]-2-(3-methylphenoxy)propanamide
CID 55361997
2-(3-methylphenoxy)propanehydrazide
CID 3021693
N-cyclododecyl-2-(3-methylphenoxy)propanamide
CID 3912808
N-cyclooctyl-2-(3-methylphenoxy)propanamide
CID 2976571
2-[[1-(dimethylamino)cyclopentyl]methylamino]-N-(3-methylphenyl)acetamide
CID 78915363
N-[[2-(hydroxymethyl)phenyl]methyl]-2-(3-methylphenoxy)propanamide
CID 110909100

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-(3-methylphenoxy)propanamide?
The IUPAC name of (2R)-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-(3-methylphenoxy)propanamide (CID 94109673) is (2R)-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-(3-methylphenoxy)propanamide.
What is the SMILES notation for (2R)-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-(3-methylphenoxy)propanamide?
The canonical SMILES for (2R)-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-(3-methylphenoxy)propanamide is Cc1cccc(O[C@H](C)C(=O)NCC2(N(C)C)CCCC2)c1.
What is the InChIKey of (2R)-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-(3-methylphenoxy)propanamide?
The InChIKey is KYVWGXWWQNPGNL-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H28N2O2/c1-14-8-7-9-16(12-14)22-15(2)17(21)19-13-18(20(3)4)10-5-6-11-18/h7-9,12,15H,5-6,10-11,13H2,1-4H3,(H,19,21)/t15-/m1/s1.
What are the key properties of (2R)-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-(3-methylphenoxy)propanamide?
(2R)-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-(3-methylphenoxy)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)-N-[[1-(dimethylamino)cyclopentyl]methyl]-2-(3-methylphenoxy)propanamide is sourced from PubChem (CID 94109673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).