N-[4-[(2R)-butan-2-yl]-2-hydroxyphenyl]-3,5-dimethoxybenzamide

C19H23NO4 — CID 26788153

IUPACN-[4-[(2R)-butan-2-yl]-2-hydroxyphenyl]-3,5-dimethoxybenzamide
SMILESCC[C@@H](C)c1ccc(NC(=O)c2cc(OC)cc(OC)c2)c(O)c1
InChIInChI=1S/C19H23NO4/c1-5-12(2)13-6-7-17(18(21)10-13)20-19(22)14-8-15(23-3)11-16(9-14)24-4/h6-12,21H,5H2,1-4H3,(H,20,22)/t12-/m1/s1
InChIKeyONAJLRGEMFPPIK-GFCCVEGCSA-N
MW329.40 g/mol
LogP4.18
Rot. Bonds6

About N-[4-[(2R)-butan-2-yl]-2-hydroxyphenyl]-3,5-dimethoxybenzamide

N-[4-[(2R)-butan-2-yl]-2-hydroxyphenyl]-3,5-dimethoxybenzamide (PubChem CID 26788153) has the molecular formula C19H23NO4 and a molecular weight of 329.40 g/mol. Its IUPAC name is N-[4-[(2R)-butan-2-yl]-2-hydroxyphenyl]-3,5-dimethoxybenzamide.

Molecular Properties

Compound NameN-[4-[(2R)-butan-2-yl]-2-hydroxyphenyl]-3,5-dimethoxybenzamide
PubChem CID26788153
Molecular FormulaC19H23NO4
Molecular Weight329.40 g/mol
Exact Mass329.16
IUPAC NameN-[4-[(2R)-butan-2-yl]-2-hydroxyphenyl]-3,5-dimethoxybenzamide
SMILESCC[C@@H](C)c1ccc(NC(=O)c2cc(OC)cc(OC)c2)c(O)c1
InChIInChI=1S/C19H23NO4/c1-5-12(2)13-6-7-17(18(21)10-13)20-19(22)14-8-15(23-3)11-16(9-14)24-4/h6-12,21H,5H2,1-4H3,(H,20,22)/t12-/m1/s1
InChIKeyONAJLRGEMFPPIK-GFCCVEGCSA-N
XLogP4.18
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

Analyze N-[4-[(2R)-butan-2-yl]-2-hydroxyphenyl]-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-[(2S)-butan-2-yl]phenyl]-3,5-dimethoxybenzamide
CID 2670827
N-(4-butan-2-yl-2-hydroxyphenyl)-2-(4-methylphenoxy)acetamide
CID 21209219
N-(3-butan-2-ylphenyl)-3-methoxybenzamide
CID 139481676
N-(4-butan-2-yl-2-hydroxyphenyl)-2-(4-ethylphenoxy)acetamide
CID 4623052
N-[(5-butan-2-yl-2-hydroxyphenyl)carbamothioyl]-3,4,5-trimethoxybenzamide
CID 2904785
N-[4-(1-aminoethyl)phenyl]-3,5-dimethoxybenzamide
CID 43822825
3-[(3,5-dimethoxybenzoyl)amino]-4-hydroxybenzoic acid
CID 108753869
3,5-dimethoxy-N-(2-methoxy-5-pentan-3-ylsulfonylphenyl)benzamide
CID 5170083
N-(2-chlorophenyl)-3,5-dimethoxybenzamide
CID 835443
N-(2,4-dihydroxyphenyl)-4-methoxybenzamide
CID 141075428
4-butan-2-yl-N-(2-hydroxyphenyl)benzamide;2-methylbutanenitrile
CID 158287072
N-[4-[ethyl(propan-2-yl)amino]phenyl]-3,5-dimethoxybenzamide
CID 7406846

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2R)-butan-2-yl]-2-hydroxyphenyl]-3,5-dimethoxybenzamide?
The IUPAC name of N-[4-[(2R)-butan-2-yl]-2-hydroxyphenyl]-3,5-dimethoxybenzamide (CID 26788153) is N-[4-[(2R)-butan-2-yl]-2-hydroxyphenyl]-3,5-dimethoxybenzamide.
What is the SMILES notation for N-[4-[(2R)-butan-2-yl]-2-hydroxyphenyl]-3,5-dimethoxybenzamide?
The canonical SMILES for N-[4-[(2R)-butan-2-yl]-2-hydroxyphenyl]-3,5-dimethoxybenzamide is CC[C@@H](C)c1ccc(NC(=O)c2cc(OC)cc(OC)c2)c(O)c1.
What is the InChIKey of N-[4-[(2R)-butan-2-yl]-2-hydroxyphenyl]-3,5-dimethoxybenzamide?
The InChIKey is ONAJLRGEMFPPIK-GFCCVEGCSA-N. The full InChI is InChI=1S/C19H23NO4/c1-5-12(2)13-6-7-17(18(21)10-13)20-19(22)14-8-15(23-3)11-16(9-14)24-4/h6-12,21H,5H2,1-4H3,(H,20,22)/t12-/m1/s1.
What are the key properties of N-[4-[(2R)-butan-2-yl]-2-hydroxyphenyl]-3,5-dimethoxybenzamide?
N-[4-[(2R)-butan-2-yl]-2-hydroxyphenyl]-3,5-dimethoxybenzamide has a molecular weight of 329.40 g/mol, XLogP of 4.18, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2R)-butan-2-yl]-2-hydroxyphenyl]-3,5-dimethoxybenzamide is sourced from PubChem (CID 26788153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).