2-methoxy-N-[4-(pyridin-3-ylcarbamoyl)cyclohexyl]benzamide

C20H23N3O3 — CID 154762622

IUPAC2-methoxy-N-[4-(pyridin-3-ylcarbamoyl)cyclohexyl]benzamide
SMILESCOc1ccccc1C(=O)NC1CCC(C(=O)Nc2cccnc2)CC1
InChIInChI=1S/C20H23N3O3/c1-26-18-7-3-2-6-17(18)20(25)22-15-10-8-14(9-11-15)19(24)23-16-5-4-12-21-13-16/h2-7,12-15H,8-11H2,1H3,(H,22,25)(H,23,24)
InChIKeyLCITUBLRVSEYDK-UHFFFAOYSA-N
MW353.42 g/mol
LogP3.02
Rot. Bonds5

About 2-methoxy-N-[4-(pyridin-3-ylcarbamoyl)cyclohexyl]benzamide

2-methoxy-N-[4-(pyridin-3-ylcarbamoyl)cyclohexyl]benzamide (PubChem CID 154762622) has the molecular formula C20H23N3O3 and a molecular weight of 353.42 g/mol. Its IUPAC name is 2-methoxy-N-[4-(pyridin-3-ylcarbamoyl)cyclohexyl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[4-(pyridin-3-ylcarbamoyl)cyclohexyl]benzamide
PubChem CID154762622
Molecular FormulaC20H23N3O3
Molecular Weight353.42 g/mol
Exact Mass353.17
IUPAC Name2-methoxy-N-[4-(pyridin-3-ylcarbamoyl)cyclohexyl]benzamide
SMILESCOc1ccccc1C(=O)NC1CCC(C(=O)Nc2cccnc2)CC1
InChIInChI=1S/C20H23N3O3/c1-26-18-7-3-2-6-17(18)20(25)22-15-10-8-14(9-11-15)19(24)23-16-5-4-12-21-13-16/h2-7,12-15H,8-11H2,1H3,(H,22,25)(H,23,24)
InChIKeyLCITUBLRVSEYDK-UHFFFAOYSA-N
XLogP3.02
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-N-[4-[(2-methoxybenzoyl)amino]cyclohexyl]benzamide
CID 1235931
1-[[(2-methoxybenzoyl)amino]carbamoyl]-N-pyridin-3-ylpyrrolidine-2-carboxamide
CID 175120141
N-(4-bromocyclohexyl)-2-methoxybenzamide
CID 113274302
4-hydroxy-N-pyridin-3-ylcyclohexane-1-carboxamide
CID 112524091
2-methoxy-N-[4-[[4-[(2-methoxybenzoyl)amino]cyclohexyl]methyl]cyclohexyl]benzamide
CID 5173361
N-[3-(cyclopentanecarbonylamino)phenyl]-2-methoxybenzamide
CID 46880084
N-[3-(cyclohexanecarbonylamino)phenyl]-2-methoxybenzamide
CID 46880083
3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide
CID 105063330
2-methoxy-N-piperidin-4-ylbenzamide
CID 16780894
4-(but-3-enylamino)-N-pyridin-3-ylcyclohexane-1-carboxamide dichloride
CID 10405208
2-methoxy-N-(4-pyrazol-1-ylcyclohexyl)benzamide
CID 126855667
2-methoxy-N-[4-(propylamino)cyclohexyl]benzamide
CID 43653454

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[4-(pyridin-3-ylcarbamoyl)cyclohexyl]benzamide?
The IUPAC name of 2-methoxy-N-[4-(pyridin-3-ylcarbamoyl)cyclohexyl]benzamide (CID 154762622) is 2-methoxy-N-[4-(pyridin-3-ylcarbamoyl)cyclohexyl]benzamide.
What is the SMILES notation for 2-methoxy-N-[4-(pyridin-3-ylcarbamoyl)cyclohexyl]benzamide?
The canonical SMILES for 2-methoxy-N-[4-(pyridin-3-ylcarbamoyl)cyclohexyl]benzamide is COc1ccccc1C(=O)NC1CCC(C(=O)Nc2cccnc2)CC1.
What is the InChIKey of 2-methoxy-N-[4-(pyridin-3-ylcarbamoyl)cyclohexyl]benzamide?
The InChIKey is LCITUBLRVSEYDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O3/c1-26-18-7-3-2-6-17(18)20(25)22-15-10-8-14(9-11-15)19(24)23-16-5-4-12-21-13-16/h2-7,12-15H,8-11H2,1H3,(H,22,25)(H,23,24).
What are the key properties of 2-methoxy-N-[4-(pyridin-3-ylcarbamoyl)cyclohexyl]benzamide?
2-methoxy-N-[4-(pyridin-3-ylcarbamoyl)cyclohexyl]benzamide has a molecular weight of 353.42 g/mol, XLogP of 3.02, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[4-(pyridin-3-ylcarbamoyl)cyclohexyl]benzamide is sourced from PubChem (CID 154762622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).