N-[(1R,2R)-2-hydroxycyclohexyl]-3-(4-methoxyphenoxy)propanamide

C16H23NO4 — CID 104927572

IUPACN-[(1R,2R)-2-hydroxycyclohexyl]-3-(4-methoxyphenoxy)propanamide
SMILESCOc1ccc(OCCC(=O)N[C@@H]2CCCC[C@H]2O)cc1
InChIInChI=1S/C16H23NO4/c1-20-12-6-8-13(9-7-12)21-11-10-16(19)17-14-4-2-3-5-15(14)18/h6-9,14-15,18H,2-5,10-11H2,1H3,(H,17,19)/t14-,15-/m1/s1
InChIKeyPWTFRVNJWNROQI-HUUCEWRRSA-N
MW293.36 g/mol
LogP1.88
Rot. Bonds6

About N-[(1R,2R)-2-hydroxycyclohexyl]-3-(4-methoxyphenoxy)propanamide

N-[(1R,2R)-2-hydroxycyclohexyl]-3-(4-methoxyphenoxy)propanamide (PubChem CID 104927572) has the molecular formula C16H23NO4 and a molecular weight of 293.36 g/mol. Its IUPAC name is N-[(1R,2R)-2-hydroxycyclohexyl]-3-(4-methoxyphenoxy)propanamide.

Molecular Properties

Compound NameN-[(1R,2R)-2-hydroxycyclohexyl]-3-(4-methoxyphenoxy)propanamide
PubChem CID104927572
Molecular FormulaC16H23NO4
Molecular Weight293.36 g/mol
Exact Mass293.16
IUPAC NameN-[(1R,2R)-2-hydroxycyclohexyl]-3-(4-methoxyphenoxy)propanamide
SMILESCOc1ccc(OCCC(=O)N[C@@H]2CCCC[C@H]2O)cc1
InChIInChI=1S/C16H23NO4/c1-20-12-6-8-13(9-7-12)21-11-10-16(19)17-14-4-2-3-5-15(14)18/h6-9,14-15,18H,2-5,10-11H2,1H3,(H,17,19)/t14-,15-/m1/s1
InChIKeyPWTFRVNJWNROQI-HUUCEWRRSA-N
XLogP1.88
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.36
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(1R,2R)-2-hydroxycyclohexyl]-3-(4-methoxyphenoxy)propanamide 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-[(1S,2S)-2-hydroxycyclohexyl]-3-(4-methylphenoxy)propanamide
CID 104956597
N-cyclohexyl-3-(4-methoxyphenoxy)propanamide
CID 974927
2-(4-methoxyphenoxy)-N-[(1R,2R)-2-[[2-(4-methoxyphenoxy)acetyl]amino]cyclohexyl]acetamide
CID 1015196
3-(2,6-dimethylphenoxy)-N-[(1S,2S)-2-hydroxycyclohexyl]propanamide
CID 104956768
2-(4-methoxyphenyl)-N-[(1S,2S)-2-[[2-(4-methoxyphenyl)acetyl]amino]cyclohexyl]acetamide
CID 1012646
2-(4-ethoxyphenoxy)-N-[(1S,2S)-2-hydroxycyclohexyl]acetamide
CID 104956604
3-(4-methoxyphenoxy)-N-piperidin-3-ylpropanamide;hydrochloride
CID 119424848
N-cyclohexyl-3-[2-(4-methoxyphenoxy)ethylsulfanyl]propanamide
CID 134001401
N-(2-hydroxycyclohexyl)-4-(3-methylphenoxy)butanamide
CID 62365265
N-[(1R,2R)-2-hydroxycyclohexyl]-3-propan-2-yloxypropanamide
CID 97245059
N-[3-(cyclohexylamino)-3-oxopropyl]-4-(4-methoxyphenoxy)butanamide
CID 55951561
3-(4-chlorophenoxy)-N-cyclopentylpropanamide
CID 108790008

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-2-hydroxycyclohexyl]-3-(4-methoxyphenoxy)propanamide?
The IUPAC name of N-[(1R,2R)-2-hydroxycyclohexyl]-3-(4-methoxyphenoxy)propanamide (CID 104927572) is N-[(1R,2R)-2-hydroxycyclohexyl]-3-(4-methoxyphenoxy)propanamide.
What is the SMILES notation for N-[(1R,2R)-2-hydroxycyclohexyl]-3-(4-methoxyphenoxy)propanamide?
The canonical SMILES for N-[(1R,2R)-2-hydroxycyclohexyl]-3-(4-methoxyphenoxy)propanamide is COc1ccc(OCCC(=O)N[C@@H]2CCCC[C@H]2O)cc1.
What is the InChIKey of N-[(1R,2R)-2-hydroxycyclohexyl]-3-(4-methoxyphenoxy)propanamide?
The InChIKey is PWTFRVNJWNROQI-HUUCEWRRSA-N. The full InChI is InChI=1S/C16H23NO4/c1-20-12-6-8-13(9-7-12)21-11-10-16(19)17-14-4-2-3-5-15(14)18/h6-9,14-15,18H,2-5,10-11H2,1H3,(H,17,19)/t14-,15-/m1/s1.
What are the key properties of N-[(1R,2R)-2-hydroxycyclohexyl]-3-(4-methoxyphenoxy)propanamide?
N-[(1R,2R)-2-hydroxycyclohexyl]-3-(4-methoxyphenoxy)propanamide has a molecular weight of 293.36 g/mol, XLogP of 1.88, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-2-hydroxycyclohexyl]-3-(4-methoxyphenoxy)propanamide is sourced from PubChem (CID 104927572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).