(2R)-N-(3-ethoxypropyl)-2-naphthalen-1-yloxybutanamide

C19H25NO3 — CID 99955185

IUPAC(2R)-N-(3-ethoxypropyl)-2-naphthalen-1-yloxybutanamide
SMILESCCOCCCNC(=O)[C@@H](CC)Oc1cccc2ccccc12
InChIInChI=1S/C19H25NO3/c1-3-17(19(21)20-13-8-14-22-4-2)23-18-12-7-10-15-9-5-6-11-16(15)18/h5-7,9-12,17H,3-4,8,13-14H2,1-2H3,(H,20,21)/t17-/m1/s1
InChIKeyZWNVPWMWKILHGC-QGZVFWFLSA-N
MW315.41 g/mol
LogP3.54
Rot. Bonds9

About (2R)-N-(3-ethoxypropyl)-2-naphthalen-1-yloxybutanamide

(2R)-N-(3-ethoxypropyl)-2-naphthalen-1-yloxybutanamide (PubChem CID 99955185) has the molecular formula C19H25NO3 and a molecular weight of 315.41 g/mol. Its IUPAC name is (2R)-N-(3-ethoxypropyl)-2-naphthalen-1-yloxybutanamide.

Molecular Properties

Compound Name(2R)-N-(3-ethoxypropyl)-2-naphthalen-1-yloxybutanamide
PubChem CID99955185
Molecular FormulaC19H25NO3
Molecular Weight315.41 g/mol
Exact Mass315.18
IUPAC Name(2R)-N-(3-ethoxypropyl)-2-naphthalen-1-yloxybutanamide
SMILESCCOCCCNC(=O)[C@@H](CC)Oc1cccc2ccccc12
InChIInChI=1S/C19H25NO3/c1-3-17(19(21)20-13-8-14-22-4-2)23-18-12-7-10-15-9-5-6-11-16(15)18/h5-7,9-12,17H,3-4,8,13-14H2,1-2H3,(H,20,21)/t17-/m1/s1
InChIKeyZWNVPWMWKILHGC-QGZVFWFLSA-N
XLogP3.54
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.41
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-naphthalen-1-yloxy-N-pentylbutanamide
CID 94012357
(2S)-2-(2-chlorophenoxy)-N-(3-ethoxypropyl)butanamide
CID 28632344
(2S)-N-ethyl-2-naphthalen-1-yloxybutanamide
CID 92675039
(2S)-N-(3-ethoxypropyl)-2-naphthalen-2-yloxybutanamide
CID 92686159
(2R)-2-naphthalen-1-yloxy-N-(2-phenylethyl)butanamide
CID 92675290
(2R)-N-[3-(4-fluorophenyl)propyl]-2-naphthalen-1-yloxybutanamide
CID 93487591
N-[3-(4-fluorophenyl)propyl]-2-naphthalen-1-yloxybutanamide
CID 43909517
(2S)-N-benzyl-2-naphthalen-1-yloxybutanamide
CID 30377459
N-(naphthalen-1-ylmethyl)-2-naphthalen-1-yloxybutanamide
CID 133218992
(2R)-2-naphthalen-1-yloxy-N-(2-phenylsulfanylethyl)butanamide
CID 92681954
N-[3-(4-chlorophenyl)propyl]-2-naphthalen-1-yloxybutanamide
CID 43909206
(2R)-N-methyl-2-naphthalen-1-yloxybutanamide
CID 30388203

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3-ethoxypropyl)-2-naphthalen-1-yloxybutanamide?
The IUPAC name of (2R)-N-(3-ethoxypropyl)-2-naphthalen-1-yloxybutanamide (CID 99955185) is (2R)-N-(3-ethoxypropyl)-2-naphthalen-1-yloxybutanamide.
What is the SMILES notation for (2R)-N-(3-ethoxypropyl)-2-naphthalen-1-yloxybutanamide?
The canonical SMILES for (2R)-N-(3-ethoxypropyl)-2-naphthalen-1-yloxybutanamide is CCOCCCNC(=O)[C@@H](CC)Oc1cccc2ccccc12.
What is the InChIKey of (2R)-N-(3-ethoxypropyl)-2-naphthalen-1-yloxybutanamide?
The InChIKey is ZWNVPWMWKILHGC-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H25NO3/c1-3-17(19(21)20-13-8-14-22-4-2)23-18-12-7-10-15-9-5-6-11-16(15)18/h5-7,9-12,17H,3-4,8,13-14H2,1-2H3,(H,20,21)/t17-/m1/s1.
What are the key properties of (2R)-N-(3-ethoxypropyl)-2-naphthalen-1-yloxybutanamide?
(2R)-N-(3-ethoxypropyl)-2-naphthalen-1-yloxybutanamide has a molecular weight of 315.41 g/mol, XLogP of 3.54, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3-ethoxypropyl)-2-naphthalen-1-yloxybutanamide is sourced from PubChem (CID 99955185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).