N'-(3-hydroxyphenyl)-N-(4-methoxycyclohexyl)butanediamide

C17H24N2O4 — CID 163312542

IUPACN'-(3-hydroxyphenyl)-N-(4-methoxycyclohexyl)butanediamide
SMILESCOC1CCC(NC(=O)CCC(=O)Nc2cccc(O)c2)CC1
InChIInChI=1S/C17H24N2O4/c1-23-15-7-5-12(6-8-15)18-16(21)9-10-17(22)19-13-3-2-4-14(20)11-13/h2-4,11-12,15,20H,5-10H2,1H3,(H,18,21)(H,19,22)
InChIKeyBQAZFDFQEJWHRO-UHFFFAOYSA-N
MW320.39 g/mol
LogP2.18
Rot. Bonds6

About N'-(3-hydroxyphenyl)-N-(4-methoxycyclohexyl)butanediamide

N'-(3-hydroxyphenyl)-N-(4-methoxycyclohexyl)butanediamide (PubChem CID 163312542) has the molecular formula C17H24N2O4 and a molecular weight of 320.39 g/mol. Its IUPAC name is N'-(3-hydroxyphenyl)-N-(4-methoxycyclohexyl)butanediamide.

Molecular Properties

Compound NameN'-(3-hydroxyphenyl)-N-(4-methoxycyclohexyl)butanediamide
PubChem CID163312542
Molecular FormulaC17H24N2O4
Molecular Weight320.39 g/mol
Exact Mass320.17
IUPAC NameN'-(3-hydroxyphenyl)-N-(4-methoxycyclohexyl)butanediamide
SMILESCOC1CCC(NC(=O)CCC(=O)Nc2cccc(O)c2)CC1
InChIInChI=1S/C17H24N2O4/c1-23-15-7-5-12(6-8-15)18-16(21)9-10-17(22)19-13-3-2-4-14(20)11-13/h2-4,11-12,15,20H,5-10H2,1H3,(H,18,21)(H,19,22)
InChIKeyBQAZFDFQEJWHRO-UHFFFAOYSA-N
XLogP2.18
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 52.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N'-(3-hydroxyphenyl)-N-(4-methoxycyclohexyl)butanediamide 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-cyclopropyl-N'-phenylbutanediamide
CID 70314355
N-(3-hydroxyphenyl)nonadecanamide
CID 19039287
N-cyclooctyl-N'-(4-hydroxy-3-methoxyphenyl)butanediamide
CID 131919860
methyl (2S)-2-amino-5-(3-hydroxyanilino)-5-oxopentanoate
CID 10705950
2-ethoxy-N-(3-hydroxyphenyl)acetamide
CID 28780663
N-cyclopentyl-N'-(3-hydroxyphenyl)oxamide
CID 44995644
2-(3,4-dichlorophenyl)-N-(4-methoxycyclohexyl)acetamide
CID 163319563
N-(3-hydroxyphenyl)-4-(4-methoxyphenyl)butanamide
CID 122135780
N-(3-cyanophenyl)-3-(4-methoxypiperidin-1-yl)propanamide
CID 43243967
N-cyclopentyl-N'-(3-pyrazol-1-ylphenyl)butanediamide
CID 131950327
N-(3-acetamidophenyl)-3-[(3R)-3-methoxypyrrolidin-1-yl]propanamide
CID 124730854
N-cyclopropyl-2-[ethyl-[2-(3-methoxyanilino)-2-oxoethyl]amino]acetamide
CID 34434295

Frequently Asked Questions

What is the IUPAC name of N'-(3-hydroxyphenyl)-N-(4-methoxycyclohexyl)butanediamide?
The IUPAC name of N'-(3-hydroxyphenyl)-N-(4-methoxycyclohexyl)butanediamide (CID 163312542) is N'-(3-hydroxyphenyl)-N-(4-methoxycyclohexyl)butanediamide.
What is the SMILES notation for N'-(3-hydroxyphenyl)-N-(4-methoxycyclohexyl)butanediamide?
The canonical SMILES for N'-(3-hydroxyphenyl)-N-(4-methoxycyclohexyl)butanediamide is COC1CCC(NC(=O)CCC(=O)Nc2cccc(O)c2)CC1.
What is the InChIKey of N'-(3-hydroxyphenyl)-N-(4-methoxycyclohexyl)butanediamide?
The InChIKey is BQAZFDFQEJWHRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O4/c1-23-15-7-5-12(6-8-15)18-16(21)9-10-17(22)19-13-3-2-4-14(20)11-13/h2-4,11-12,15,20H,5-10H2,1H3,(H,18,21)(H,19,22).
What are the key properties of N'-(3-hydroxyphenyl)-N-(4-methoxycyclohexyl)butanediamide?
N'-(3-hydroxyphenyl)-N-(4-methoxycyclohexyl)butanediamide has a molecular weight of 320.39 g/mol, XLogP of 2.18, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-hydroxyphenyl)-N-(4-methoxycyclohexyl)butanediamide is sourced from PubChem (CID 163312542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).