3-methoxy-N-[(2S)-4-phenylbutan-2-yl]naphthalene-2-carboxamide

C22H23NO2 — CID 26290914

IUPAC3-methoxy-N-[(2S)-4-phenylbutan-2-yl]naphthalene-2-carboxamide
SMILESCOc1cc2ccccc2cc1C(=O)N[C@@H](C)CCc1ccccc1
InChIInChI=1S/C22H23NO2/c1-16(12-13-17-8-4-3-5-9-17)23-22(24)20-14-18-10-6-7-11-19(18)15-21(20)25-2/h3-11,14-16H,12-13H2,1-2H3,(H,23,24)/t16-/m0/s1
InChIKeyDCSXHVTUCBWTQS-INIZCTEOSA-N
MW333.43 g/mol
LogP4.60
Rot. Bonds6

About 3-methoxy-N-[(2S)-4-phenylbutan-2-yl]naphthalene-2-carboxamide

3-methoxy-N-[(2S)-4-phenylbutan-2-yl]naphthalene-2-carboxamide (PubChem CID 26290914) has the molecular formula C22H23NO2 and a molecular weight of 333.43 g/mol. Its IUPAC name is 3-methoxy-N-[(2S)-4-phenylbutan-2-yl]naphthalene-2-carboxamide.

Molecular Properties

Compound Name3-methoxy-N-[(2S)-4-phenylbutan-2-yl]naphthalene-2-carboxamide
PubChem CID26290914
Molecular FormulaC22H23NO2
Molecular Weight333.43 g/mol
Exact Mass333.17
IUPAC Name3-methoxy-N-[(2S)-4-phenylbutan-2-yl]naphthalene-2-carboxamide
SMILESCOc1cc2ccccc2cc1C(=O)N[C@@H](C)CCc1ccccc1
InChIInChI=1S/C22H23NO2/c1-16(12-13-17-8-4-3-5-9-17)23-22(24)20-14-18-10-6-7-11-19(18)15-21(20)25-2/h3-11,14-16H,12-13H2,1-2H3,(H,23,24)/t16-/m0/s1
InChIKeyDCSXHVTUCBWTQS-INIZCTEOSA-N
XLogP4.60
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.43
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methoxy-N-[(2S)-4-phenylbutan-2-yl]naphthalene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-methoxy-N-[(2S)-1-phenylpropan-2-yl]naphthalene-2-carboxamide
CID 706056
[(2S)-1-oxo-1-[[(2R)-4-phenylbutan-2-yl]amino]propan-2-yl] 3-methoxynaphthalene-2-carboxylate
CID 7766836
4-acetamido-5-chloro-2-methoxy-N-[(2R)-4-phenylbutan-2-yl]benzamide
CID 7356959
4-methoxy-N-[(2R)-4-phenylbutan-2-yl]benzamide
CID 854833
3-methoxy-N-(3-methylbutan-2-yl)naphthalene-2-carboxamide
CID 133250038
5-methoxy-4-oxo-N-[(2S)-4-phenylbutan-2-yl]pyran-2-carboxamide
CID 27378261
3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide
CID 92675789
4-ethoxy-3-methoxy-N-[(2R)-4-phenylbutan-2-yl]benzamide
CID 1243127
N-[2-(dimethylamino)-3-phenylpropyl]-3-methoxynaphthalene-2-carboxamide
CID 18109898
5-bromo-2-ethoxy-N-(4-phenylbutan-2-yl)benzamide
CID 2947744
5-(azepan-1-ylsulfonyl)-2-methoxy-N-[(2S)-4-phenylbutan-2-yl]benzamide
CID 51904194
4-methoxy-3-(phenoxymethyl)-N-(4-phenylbutan-2-yl)benzamide
CID 133149991

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[(2S)-4-phenylbutan-2-yl]naphthalene-2-carboxamide?
The IUPAC name of 3-methoxy-N-[(2S)-4-phenylbutan-2-yl]naphthalene-2-carboxamide (CID 26290914) is 3-methoxy-N-[(2S)-4-phenylbutan-2-yl]naphthalene-2-carboxamide.
What is the SMILES notation for 3-methoxy-N-[(2S)-4-phenylbutan-2-yl]naphthalene-2-carboxamide?
The canonical SMILES for 3-methoxy-N-[(2S)-4-phenylbutan-2-yl]naphthalene-2-carboxamide is COc1cc2ccccc2cc1C(=O)N[C@@H](C)CCc1ccccc1.
What is the InChIKey of 3-methoxy-N-[(2S)-4-phenylbutan-2-yl]naphthalene-2-carboxamide?
The InChIKey is DCSXHVTUCBWTQS-INIZCTEOSA-N. The full InChI is InChI=1S/C22H23NO2/c1-16(12-13-17-8-4-3-5-9-17)23-22(24)20-14-18-10-6-7-11-19(18)15-21(20)25-2/h3-11,14-16H,12-13H2,1-2H3,(H,23,24)/t16-/m0/s1.
What are the key properties of 3-methoxy-N-[(2S)-4-phenylbutan-2-yl]naphthalene-2-carboxamide?
3-methoxy-N-[(2S)-4-phenylbutan-2-yl]naphthalene-2-carboxamide has a molecular weight of 333.43 g/mol, XLogP of 4.60, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[(2S)-4-phenylbutan-2-yl]naphthalene-2-carboxamide is sourced from PubChem (CID 26290914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).