(2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]pentanamide

C22H31NO3 — CID 100760364

IUPAC(2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]pentanamide
SMILESCCC[C@@](C)(OCC)C(=O)Nc1ccc(OCC(C)C)c2ccccc12
InChIInChI=1S/C22H31NO3/c1-6-14-22(5,26-7-2)21(24)23-19-12-13-20(25-15-16(3)4)18-11-9-8-10-17(18)19/h8-13,16H,6-7,14-15H2,1-5H3,(H,23,24)/t22-/m1/s1
InChIKeyOXWXAZWZYOKMAU-JOCHJYFZSA-N
MW357.49 g/mol
LogP5.41
Rot. Bonds9

About (2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]pentanamide

(2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]pentanamide (PubChem CID 100760364) has the molecular formula C22H31NO3 and a molecular weight of 357.49 g/mol. Its IUPAC name is (2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]pentanamide.

Molecular Properties

Compound Name(2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]pentanamide
PubChem CID100760364
Molecular FormulaC22H31NO3
Molecular Weight357.49 g/mol
Exact Mass357.23
IUPAC Name(2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]pentanamide
SMILESCCC[C@@](C)(OCC)C(=O)Nc1ccc(OCC(C)C)c2ccccc12
InChIInChI=1S/C22H31NO3/c1-6-14-22(5,26-7-2)21(24)23-19-12-13-20(25-15-16(3)4)18-11-9-8-10-17(18)19/h8-13,16H,6-7,14-15H2,1-5H3,(H,23,24)/t22-/m1/s1
InChIKeyOXWXAZWZYOKMAU-JOCHJYFZSA-N
XLogP5.41
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.49
LogP ≤ 55.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]hexanamide
CID 100761072
(2R)-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]-2-propoxyhexanamide
CID 100766183
2-methoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]propanamide
CID 100752413
N-(4-butan-2-yloxynaphthalen-1-yl)-2-ethoxy-2-methylheptanamide
CID 133203923
(2S)-2-ethoxy-N-(4-methoxynaphthalen-1-yl)-2-methylheptanamide
CID 100761479
N-(4-ethoxynaphthalen-1-yl)-2-methyl-2-propoxybutanamide
CID 133204053
(2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)phenyl]pentanamide
CID 100724348
(2R)-N-(8-butoxyquinolin-5-yl)-2-ethoxy-2-methylpentanamide
CID 100776505
2-methyl-N-(4-propan-2-yloxynaphthalen-1-yl)-2-propoxyhexanamide
CID 133205372
N-(4-ethoxynaphthalen-1-yl)-4-methyl-2-(2-methylpropyl)-2-propoxypentanamide
CID 100765689
2-methoxy-2-methyl-N-(4-propoxynaphthalen-1-yl)butanamide
CID 133229716
(2S)-N-(8-butoxyquinolin-5-yl)-2-ethoxy-2-methylhexanamide
CID 100776734

Frequently Asked Questions

What is the IUPAC name of (2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]pentanamide?
The IUPAC name of (2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]pentanamide (CID 100760364) is (2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]pentanamide.
What is the SMILES notation for (2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]pentanamide?
The canonical SMILES for (2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]pentanamide is CCC[C@@](C)(OCC)C(=O)Nc1ccc(OCC(C)C)c2ccccc12.
What is the InChIKey of (2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]pentanamide?
The InChIKey is OXWXAZWZYOKMAU-JOCHJYFZSA-N. The full InChI is InChI=1S/C22H31NO3/c1-6-14-22(5,26-7-2)21(24)23-19-12-13-20(25-15-16(3)4)18-11-9-8-10-17(18)19/h8-13,16H,6-7,14-15H2,1-5H3,(H,23,24)/t22-/m1/s1.
What are the key properties of (2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]pentanamide?
(2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]pentanamide has a molecular weight of 357.49 g/mol, XLogP of 5.41, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-ethoxy-2-methyl-N-[4-(2-methylpropoxy)naphthalen-1-yl]pentanamide is sourced from PubChem (CID 100760364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).