4-(2-methoxyethoxy)-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide

C22H34N2O3 — CID 24873264

IUPAC4-(2-methoxyethoxy)-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide
SMILESCOCCOc1ccc(C(=O)N[C@@H]2CCCC[C@H]2CN2CCCCC2)cc1
InChIInChI=1S/C22H34N2O3/c1-26-15-16-27-20-11-9-18(10-12-20)22(25)23-21-8-4-3-7-19(21)17-24-13-5-2-6-14-24/h9-12,19,21H,2-8,13-17H2,1H3,(H,23,25)/t19-,21+/m0/s1
InChIKeyVFTOCQUFKCBTCR-PZJWPPBQSA-N
MW374.53 g/mol
LogP3.49
Rot. Bonds8

About 4-(2-methoxyethoxy)-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide

4-(2-methoxyethoxy)-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide (PubChem CID 24873264) has the molecular formula C22H34N2O3 and a molecular weight of 374.53 g/mol. Its IUPAC name is 4-(2-methoxyethoxy)-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide.

Molecular Properties

Compound Name4-(2-methoxyethoxy)-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide
PubChem CID24873264
Molecular FormulaC22H34N2O3
Molecular Weight374.53 g/mol
Exact Mass374.26
IUPAC Name4-(2-methoxyethoxy)-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide
SMILESCOCCOc1ccc(C(=O)N[C@@H]2CCCC[C@H]2CN2CCCCC2)cc1
InChIInChI=1S/C22H34N2O3/c1-26-15-16-27-20-11-9-18(10-12-20)22(25)23-21-8-4-3-7-19(21)17-24-13-5-2-6-14-24/h9-12,19,21H,2-8,13-17H2,1H3,(H,23,25)/t19-,21+/m0/s1
InChIKeyVFTOCQUFKCBTCR-PZJWPPBQSA-N
XLogP3.49
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.53
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-(2-methoxyethoxy)-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide 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

cis-(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexan-1-amine;4-methoxy-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide
CID 159696252
4-methoxy-N-[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]benzamide
CID 74340324
4-acetamido-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide
CID 24871867
N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]thiophene-3-carboxamide
CID 24871869
N-[2-(aminomethyl)cyclohexyl]-4-butoxybenzamide
CID 119610066
N-[(1S,2R)-2-(azepan-1-ylmethyl)cyclohexyl]-4-pyrazol-1-ylbenzamide
CID 59007588
N-[(1R,2R,3R)-2-hydroxy-3-methoxycyclohexyl]-4-(2-pyrrolidin-1-ylethoxy)benzamide
CID 110145734
N-[(1R,2S)-2-(methoxymethyl)cyclopentyl]-4-pyrrolidin-1-ylbenzamide
CID 91772007
N-[(1R,2R)-2-(diethylaminomethyl)cyclohexyl]-4-(2-ethoxyethoxy)benzamide
CID 24872684
N-[2-(aminomethyl)cyclohexyl]-3-(2-methoxyethoxy)benzamide
CID 119609171
2-chloro-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide
CID 24872464
4-[[(3R,4R)-4-hydroxy-3-[[4-(2-methoxyethoxy)benzoyl]amino]azepan-1-yl]methyl]benzoic acid
CID 26742263

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyethoxy)-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide?
The IUPAC name of 4-(2-methoxyethoxy)-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide (CID 24873264) is 4-(2-methoxyethoxy)-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide.
What is the SMILES notation for 4-(2-methoxyethoxy)-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide?
The canonical SMILES for 4-(2-methoxyethoxy)-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide is COCCOc1ccc(C(=O)N[C@@H]2CCCC[C@H]2CN2CCCCC2)cc1.
What is the InChIKey of 4-(2-methoxyethoxy)-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide?
The InChIKey is VFTOCQUFKCBTCR-PZJWPPBQSA-N. The full InChI is InChI=1S/C22H34N2O3/c1-26-15-16-27-20-11-9-18(10-12-20)22(25)23-21-8-4-3-7-19(21)17-24-13-5-2-6-14-24/h9-12,19,21H,2-8,13-17H2,1H3,(H,23,25)/t19-,21+/m0/s1.
What are the key properties of 4-(2-methoxyethoxy)-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide?
4-(2-methoxyethoxy)-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide has a molecular weight of 374.53 g/mol, XLogP of 3.49, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyethoxy)-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide is sourced from PubChem (CID 24873264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).