N-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxybenzamide

C19H23NO3 — CID 2670827

IUPACN-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxybenzamide
SMILESCC[C@H](C)c1ccccc1NC(=O)c1cc(OC)cc(OC)c1
InChIInChI=1S/C19H23NO3/c1-5-13(2)17-8-6-7-9-18(17)20-19(21)14-10-15(22-3)12-16(11-14)23-4/h6-13H,5H2,1-4H3,(H,20,21)/t13-/m0/s1
InChIKeyDXAJHWILMUCRHP-ZDUSSCGKSA-N
MW313.40 g/mol
LogP4.47
Rot. Bonds6

About N-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxybenzamide

N-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxybenzamide (PubChem CID 2670827) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxybenzamide.

Molecular Properties

Compound NameN-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxybenzamide
PubChem CID2670827
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC NameN-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxybenzamide
SMILESCC[C@H](C)c1ccccc1NC(=O)c1cc(OC)cc(OC)c1
InChIInChI=1S/C19H23NO3/c1-5-13(2)17-8-6-7-9-18(17)20-19(21)14-10-15(22-3)12-16(11-14)23-4/h6-13H,5H2,1-4H3,(H,20,21)/t13-/m0/s1
InChIKeyDXAJHWILMUCRHP-ZDUSSCGKSA-N
XLogP4.47
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxybenzamide 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

N-(2-butan-2-ylphenyl)-3,4,5-trimethoxybenzamide
CID 11841254
N-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxy-4-methylbenzamide
CID 2669248
N-[2-[(2R)-butan-2-yl]phenyl]benzamide
CID 849169
N-[2-[(2S)-butan-2-yl]phenyl]-3-(2-methylpropoxy)benzamide
CID 959928
[4-[[2-[(2R)-butan-2-yl]phenyl]carbamoyl]phenyl] acetate
CID 41121356
N-[2-[(2R)-butan-2-yl]phenyl]-3-iodobenzamide
CID 2670800
N-[2-[(2S)-butan-2-yl]phenyl]-4-(2-methylpropoxy)benzamide
CID 959904
N-[4-[(2R)-butan-2-yl]-2-hydroxyphenyl]-3,5-dimethoxybenzamide
CID 26788153
N-[2-[(2R)-butan-2-yl]phenyl]acetamide
CID 959734
(E)-N-(2-butan-2-ylphenyl)-3-(4-methoxy-2,6-dimethylphenyl)prop-2-enamide
CID 84552099
[2-[2-[(2R)-butan-2-yl]anilino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate
CID 7882709
N-[2-(ethylaminomethyl)phenyl]-3,5-dimethoxybenzamide
CID 119438730

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxybenzamide?
The IUPAC name of N-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxybenzamide (CID 2670827) is N-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxybenzamide.
What is the SMILES notation for N-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxybenzamide?
The canonical SMILES for N-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxybenzamide is CC[C@H](C)c1ccccc1NC(=O)c1cc(OC)cc(OC)c1.
What is the InChIKey of N-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxybenzamide?
The InChIKey is DXAJHWILMUCRHP-ZDUSSCGKSA-N. The full InChI is InChI=1S/C19H23NO3/c1-5-13(2)17-8-6-7-9-18(17)20-19(21)14-10-15(22-3)12-16(11-14)23-4/h6-13H,5H2,1-4H3,(H,20,21)/t13-/m0/s1.
What are the key properties of N-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxybenzamide?
N-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxybenzamide has a molecular weight of 313.40 g/mol, XLogP of 4.47, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxybenzamide is sourced from PubChem (CID 2670827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).