(2R)-N-(4-butylphenyl)-2-naphthalen-2-yloxybutanamide

C24H27NO2 — CID 28573574

IUPAC(2R)-N-(4-butylphenyl)-2-naphthalen-2-yloxybutanamide
SMILESCCCCc1ccc(NC(=O)[C@@H](CC)Oc2ccc3ccccc3c2)cc1
InChIInChI=1S/C24H27NO2/c1-3-5-8-18-11-14-21(15-12-18)25-24(26)23(4-2)27-22-16-13-19-9-6-7-10-20(19)17-22/h6-7,9-17,23H,3-5,8H2,1-2H3,(H,25,26)/t23-/m1/s1
InChIKeyUUORVCBWNZHBBD-HSZRJFAPSA-N
MW361.49 g/mol
LogP5.98
Rot. Bonds8

About (2R)-N-(4-butylphenyl)-2-naphthalen-2-yloxybutanamide

(2R)-N-(4-butylphenyl)-2-naphthalen-2-yloxybutanamide (PubChem CID 28573574) has the molecular formula C24H27NO2 and a molecular weight of 361.49 g/mol. Its IUPAC name is (2R)-N-(4-butylphenyl)-2-naphthalen-2-yloxybutanamide.

Molecular Properties

Compound Name(2R)-N-(4-butylphenyl)-2-naphthalen-2-yloxybutanamide
PubChem CID28573574
Molecular FormulaC24H27NO2
Molecular Weight361.49 g/mol
Exact Mass361.20
IUPAC Name(2R)-N-(4-butylphenyl)-2-naphthalen-2-yloxybutanamide
SMILESCCCCc1ccc(NC(=O)[C@@H](CC)Oc2ccc3ccccc3c2)cc1
InChIInChI=1S/C24H27NO2/c1-3-5-8-18-11-14-21(15-12-18)25-24(26)23(4-2)27-22-16-13-19-9-6-7-10-20(19)17-22/h6-7,9-17,23H,3-5,8H2,1-2H3,(H,25,26)/t23-/m1/s1
InChIKeyUUORVCBWNZHBBD-HSZRJFAPSA-N
XLogP5.98
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.49
LogP ≤ 55.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-ethylphenyl)-2-naphthalen-2-yloxybutanamide
CID 43904923
(2S)-N-naphthalen-2-yl-2-naphthalen-2-yloxybutanamide
CID 99942620
N-(4-butylphenyl)-2-(3,4-dimethylphenoxy)butanamide
CID 43907479
N-(4-ethoxyphenyl)-2-naphthalen-2-yloxybutanamide
CID 53284524
methyl 4-[[(2R)-2-naphthalen-2-yloxybutanoyl]amino]benzoate
CID 30382427
methyl 4-(2-naphthalen-2-yloxybutanoylamino)benzoate
CID 43904604
2-naphthalen-2-yloxy-N-[4-(trifluoromethyl)phenyl]butanamide
CID 17071471
(2R)-N-naphthalen-2-yl-2-phenoxybutanamide
CID 896831
3-(4-butylphenyl)-2-naphthalen-2-yloxypropanoic acid
CID 133241307
(2S)-N-[3-(4-fluorophenyl)propyl]-2-naphthalen-2-yloxybutanamide
CID 94012280
(2S)-2-naphthalen-2-yloxy-N-pentylbutanamide
CID 92647112
1-(4-butylphenyl)-3-naphthalen-2-ylurea
CID 17265768

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(4-butylphenyl)-2-naphthalen-2-yloxybutanamide?
The IUPAC name of (2R)-N-(4-butylphenyl)-2-naphthalen-2-yloxybutanamide (CID 28573574) is (2R)-N-(4-butylphenyl)-2-naphthalen-2-yloxybutanamide.
What is the SMILES notation for (2R)-N-(4-butylphenyl)-2-naphthalen-2-yloxybutanamide?
The canonical SMILES for (2R)-N-(4-butylphenyl)-2-naphthalen-2-yloxybutanamide is CCCCc1ccc(NC(=O)[C@@H](CC)Oc2ccc3ccccc3c2)cc1.
What is the InChIKey of (2R)-N-(4-butylphenyl)-2-naphthalen-2-yloxybutanamide?
The InChIKey is UUORVCBWNZHBBD-HSZRJFAPSA-N. The full InChI is InChI=1S/C24H27NO2/c1-3-5-8-18-11-14-21(15-12-18)25-24(26)23(4-2)27-22-16-13-19-9-6-7-10-20(19)17-22/h6-7,9-17,23H,3-5,8H2,1-2H3,(H,25,26)/t23-/m1/s1.
What are the key properties of (2R)-N-(4-butylphenyl)-2-naphthalen-2-yloxybutanamide?
(2R)-N-(4-butylphenyl)-2-naphthalen-2-yloxybutanamide has a molecular weight of 361.49 g/mol, XLogP of 5.98, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(4-butylphenyl)-2-naphthalen-2-yloxybutanamide is sourced from PubChem (CID 28573574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).