3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide

C21H21NO2 — CID 92675789

IUPAC3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide
SMILESCC[C@H](NC(=O)c1cc2ccccc2cc1OC)c1ccccc1
InChIInChI=1S/C21H21NO2/c1-3-19(15-9-5-4-6-10-15)22-21(23)18-13-16-11-7-8-12-17(16)14-20(18)24-2/h4-14,19H,3H2,1-2H3,(H,22,23)/t19-/m0/s1
InChIKeyDIXUDSAGOQQDDU-IBGZPJMESA-N
MW319.40 g/mol
LogP4.73
Rot. Bonds5

About 3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide

3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide (PubChem CID 92675789) has the molecular formula C21H21NO2 and a molecular weight of 319.40 g/mol. Its IUPAC name is 3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide.

Molecular Properties

Compound Name3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide
PubChem CID92675789
Molecular FormulaC21H21NO2
Molecular Weight319.40 g/mol
Exact Mass319.16
IUPAC Name3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide
SMILESCC[C@H](NC(=O)c1cc2ccccc2cc1OC)c1ccccc1
InChIInChI=1S/C21H21NO2/c1-3-19(15-9-5-4-6-10-15)22-21(23)18-13-16-11-7-8-12-17(16)14-20(18)24-2/h4-14,19H,3H2,1-2H3,(H,22,23)/t19-/m0/s1
InChIKeyDIXUDSAGOQQDDU-IBGZPJMESA-N
XLogP4.73
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.40
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methoxy-N-[(1S)-1-phenylpropyl]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-[(1R)-1-(4-methoxyphenyl)propyl]naphthalene-2-carboxamide
CID 9115734
2-ethyl-4,5-dimethoxy-N-(1-phenylpropyl)benzamide
CID 56728765
4,5-dimethoxy-2-methyl-N-(1-phenylpropyl)benzamide
CID 56728755
3-methoxy-N-[(2S)-1-phenylpropan-2-yl]naphthalene-2-carboxamide
CID 706056
3-methoxy-N-(3-methylbutan-2-yl)naphthalene-2-carboxamide
CID 133250038
3-methoxy-N-[(2S)-4-phenylbutan-2-yl]naphthalene-2-carboxamide
CID 26290914
3-[(2,4-dimethoxybenzoyl)amino]-3-phenylpropanoic acid
CID 45461179
N-[(1R)-2-hydroxy-1-phenylethyl]-2-methoxybenzamide
CID 39370043
N-[(1S)-1-(4-methoxyphenyl)propyl]-2-methylbenzamide
CID 28979661
2-oxo-N-[(1R)-1-phenylpropyl]chromene-3-carboxamide
CID 40635761
3-methoxy-N-[2-[[(1R)-1-phenylethyl]carbamoyl]phenyl]naphthalene-2-carboxamide
CID 92674914
2-amino-6-methoxy-N-(1-phenylpropyl)benzamide
CID 81394668

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide?
The IUPAC name of 3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide (CID 92675789) is 3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide.
What is the SMILES notation for 3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide?
The canonical SMILES for 3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide is CC[C@H](NC(=O)c1cc2ccccc2cc1OC)c1ccccc1.
What is the InChIKey of 3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide?
The InChIKey is DIXUDSAGOQQDDU-IBGZPJMESA-N. The full InChI is InChI=1S/C21H21NO2/c1-3-19(15-9-5-4-6-10-15)22-21(23)18-13-16-11-7-8-12-17(16)14-20(18)24-2/h4-14,19H,3H2,1-2H3,(H,22,23)/t19-/m0/s1.
What are the key properties of 3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide?
3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide has a molecular weight of 319.40 g/mol, XLogP of 4.73, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide is sourced from PubChem (CID 92675789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).