N-tert-butyl-2-(2-hydroxynaphthalen-1-yl)-2-phenylacetamide

C22H23NO2 — CID 154088304

IUPACN-tert-butyl-2-(2-hydroxynaphthalen-1-yl)-2-phenylacetamide
SMILESCC(C)(C)NC(=O)C(c1ccccc1)c1c(O)ccc2ccccc12
InChIInChI=1S/C22H23NO2/c1-22(2,3)23-21(25)19(16-10-5-4-6-11-16)20-17-12-8-7-9-15(17)13-14-18(20)24/h4-14,19,24H,1-3H3,(H,23,25)
InChIKeyWAGMVHBXGLXBIR-UHFFFAOYSA-N
MW333.43 g/mol
LogP4.59
Rot. Bonds3

About N-tert-butyl-2-(2-hydroxynaphthalen-1-yl)-2-phenylacetamide

N-tert-butyl-2-(2-hydroxynaphthalen-1-yl)-2-phenylacetamide (PubChem CID 154088304) has the molecular formula C22H23NO2 and a molecular weight of 333.43 g/mol. Its IUPAC name is N-tert-butyl-2-(2-hydroxynaphthalen-1-yl)-2-phenylacetamide.

Molecular Properties

Compound NameN-tert-butyl-2-(2-hydroxynaphthalen-1-yl)-2-phenylacetamide
PubChem CID154088304
Molecular FormulaC22H23NO2
Molecular Weight333.43 g/mol
Exact Mass333.17
IUPAC NameN-tert-butyl-2-(2-hydroxynaphthalen-1-yl)-2-phenylacetamide
SMILESCC(C)(C)NC(=O)C(c1ccccc1)c1c(O)ccc2ccccc12
InChIInChI=1S/C22H23NO2/c1-22(2,3)23-21(25)19(16-10-5-4-6-11-16)20-17-12-8-7-9-15(17)13-14-18(20)24/h4-14,19,24H,1-3H3,(H,23,25)
InChIKeyWAGMVHBXGLXBIR-UHFFFAOYSA-N
XLogP4.59
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.43
LogP ≤ 54.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 2-(2-hydroxynaphthalen-1-yl)-2-(4-methoxyphenyl)acetate
CID 155933400
2,2,2-trifluoro-N-[(S)-(2-hydroxynaphthalen-1-yl)-phenylmethyl]acetamide
CID 721381
1-[(1S)-1-hydroxyethyl]naphthalen-2-ol
CID 95420538
1-[(R)-amino(phenyl)methyl]naphthalen-2-ol
CID 6935961
N-tert-butyl-2-phenyl-2-pyridin-2-ylacetamide
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N-tert-butyl-2-(naphthalen-1-ylmethylamino)propanamide
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benzene-1,2-diol;2,2-diphenylacetic acid
CID 70395054
N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]-2,2-diphenylacetamide
CID 135679666
2-[(1-hydroxynaphthalene-2-carbonyl)amino]-2,3-dimethylbutanoic acid
CID 150097816
4-(4-tert-butylphenoxy)-N-[(2-hydroxynaphthalen-1-yl)-phenylmethyl]butanamide
CID 19173596
N-[(2-hydroxynaphthalen-1-yl)-phenylmethyl]-2-methoxybenzamide
CID 2787112
N-[(2-hydroxynaphthalen-1-yl)-phenylmethyl]-4-iodobenzamide
CID 19166399

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(2-hydroxynaphthalen-1-yl)-2-phenylacetamide?
The IUPAC name of N-tert-butyl-2-(2-hydroxynaphthalen-1-yl)-2-phenylacetamide (CID 154088304) is N-tert-butyl-2-(2-hydroxynaphthalen-1-yl)-2-phenylacetamide.
What is the SMILES notation for N-tert-butyl-2-(2-hydroxynaphthalen-1-yl)-2-phenylacetamide?
The canonical SMILES for N-tert-butyl-2-(2-hydroxynaphthalen-1-yl)-2-phenylacetamide is CC(C)(C)NC(=O)C(c1ccccc1)c1c(O)ccc2ccccc12.
What is the InChIKey of N-tert-butyl-2-(2-hydroxynaphthalen-1-yl)-2-phenylacetamide?
The InChIKey is WAGMVHBXGLXBIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO2/c1-22(2,3)23-21(25)19(16-10-5-4-6-11-16)20-17-12-8-7-9-15(17)13-14-18(20)24/h4-14,19,24H,1-3H3,(H,23,25).
What are the key properties of N-tert-butyl-2-(2-hydroxynaphthalen-1-yl)-2-phenylacetamide?
N-tert-butyl-2-(2-hydroxynaphthalen-1-yl)-2-phenylacetamide has a molecular weight of 333.43 g/mol, XLogP of 4.59, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(2-hydroxynaphthalen-1-yl)-2-phenylacetamide is sourced from PubChem (CID 154088304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).