4-methoxy-N-[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]benzamide

C21H32N2O2 — CID 74340324

IUPAC4-methoxy-N-[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]benzamide
SMILESCOc1ccc(C(=O)NC2CCCCC2CN2CCC(C)CC2)cc1
InChIInChI=1S/C21H32N2O2/c1-16-11-13-23(14-12-16)15-18-5-3-4-6-20(18)22-21(24)17-7-9-19(25-2)10-8-17/h7-10,16,18,20H,3-6,11-15H2,1-2H3,(H,22,24)
InChIKeyYERNNMAVFDGEKI-UHFFFAOYSA-N
MW344.50 g/mol
LogP3.72
Rot. Bonds5

About 4-methoxy-N-[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]benzamide

4-methoxy-N-[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]benzamide (PubChem CID 74340324) has the molecular formula C21H32N2O2 and a molecular weight of 344.50 g/mol. Its IUPAC name is 4-methoxy-N-[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]benzamide
PubChem CID74340324
Molecular FormulaC21H32N2O2
Molecular Weight344.50 g/mol
Exact Mass344.25
IUPAC Name4-methoxy-N-[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]benzamide
SMILESCOc1ccc(C(=O)NC2CCCCC2CN2CCC(C)CC2)cc1
InChIInChI=1S/C21H32N2O2/c1-16-11-13-23(14-12-16)15-18-5-3-4-6-20(18)22-21(24)17-7-9-19(25-2)10-8-17/h7-10,16,18,20H,3-6,11-15H2,1-2H3,(H,22,24)
InChIKeyYERNNMAVFDGEKI-UHFFFAOYSA-N
XLogP3.72
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.50
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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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-(2-methoxyethoxy)-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide
CID 24873264
N-[(3S,4R,5S)-4-hydroxy-5-[(4-methylpiperidin-1-yl)methyl]oxolan-3-yl]-4-methoxybenzamide
CID 125416740
N-[2-[(dimethylamino)methyl]cyclohexyl]-4-methoxybenzamide
CID 110279273
4-acetamido-N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]benzamide
CID 24871867
4-amino-5-chloro-2-methoxy-N-[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]benzamide;hydrate;hydrochloride
CID 19108540
N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-4-methoxybenzamide
CID 51665263
(4-methoxyphenyl)-[3-(4-methoxyphenyl)-4-[(4-methylpiperidin-1-yl)methyl]pyrrolidin-1-yl]methanone
CID 42862684
4-ethoxy-N-[2-(hydroxymethyl)cyclopentyl]benzamide
CID 103751428
N-[(1R,2S)-2-(methoxymethyl)cyclopentyl]-4-pyrrolidin-1-ylbenzamide
CID 91772007
4-methoxy-N-(2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-8-yl)benzamide
CID 23620928
N-[(1R,2S)-2-(piperidin-1-ylmethyl)cyclohexyl]thiophene-3-carboxamide
CID 24871869

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]benzamide?
The IUPAC name of 4-methoxy-N-[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]benzamide (CID 74340324) is 4-methoxy-N-[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]benzamide.
What is the SMILES notation for 4-methoxy-N-[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]benzamide?
The canonical SMILES for 4-methoxy-N-[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]benzamide is COc1ccc(C(=O)NC2CCCCC2CN2CCC(C)CC2)cc1.
What is the InChIKey of 4-methoxy-N-[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]benzamide?
The InChIKey is YERNNMAVFDGEKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H32N2O2/c1-16-11-13-23(14-12-16)15-18-5-3-4-6-20(18)22-21(24)17-7-9-19(25-2)10-8-17/h7-10,16,18,20H,3-6,11-15H2,1-2H3,(H,22,24).
What are the key properties of 4-methoxy-N-[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]benzamide?
4-methoxy-N-[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]benzamide has a molecular weight of 344.50 g/mol, XLogP of 3.72, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]benzamide is sourced from PubChem (CID 74340324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).