N-cyclohexyl-2-ethoxy-3-methoxybenzamide

C16H23NO3 — CID 2988102

IUPACN-cyclohexyl-2-ethoxy-3-methoxybenzamide
SMILESCCOc1c(OC)cccc1C(=O)NC1CCCCC1
InChIInChI=1S/C16H23NO3/c1-3-20-15-13(10-7-11-14(15)19-2)16(18)17-12-8-5-4-6-9-12/h7,10-12H,3-6,8-9H2,1-2H3,(H,17,18)
InChIKeyXFFPVROHAUPHDT-UHFFFAOYSA-N
MW277.36 g/mol
LogP3.16
Rot. Bonds5

About N-cyclohexyl-2-ethoxy-3-methoxybenzamide

N-cyclohexyl-2-ethoxy-3-methoxybenzamide (PubChem CID 2988102) has the molecular formula C16H23NO3 and a molecular weight of 277.36 g/mol. Its IUPAC name is N-cyclohexyl-2-ethoxy-3-methoxybenzamide.

Molecular Properties

Compound NameN-cyclohexyl-2-ethoxy-3-methoxybenzamide
PubChem CID2988102
Molecular FormulaC16H23NO3
Molecular Weight277.36 g/mol
Exact Mass277.17
IUPAC NameN-cyclohexyl-2-ethoxy-3-methoxybenzamide
SMILESCCOc1c(OC)cccc1C(=O)NC1CCCCC1
InChIInChI=1S/C16H23NO3/c1-3-20-15-13(10-7-11-14(15)19-2)16(18)17-12-8-5-4-6-9-12/h7,10-12H,3-6,8-9H2,1-2H3,(H,17,18)
InChIKeyXFFPVROHAUPHDT-UHFFFAOYSA-N
XLogP3.16
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.36
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclohexyl-2-ethoxy-3-methoxybenzamide 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-[1-(cyclohexylmethyl)piperidin-4-yl]-2,3-dimethoxybenzamide
CID 24848457
N-cyclohexyl-2-[(2,3-dimethoxyphenoxy)methyl]benzamide
CID 91016522
2,3-dimethoxy-N-[4-(methylamino)cyclohexyl]benzamide
CID 43653208
N-cyclopentyl-2,6-diethoxybenzamide
CID 118034872
methyl 2-ethoxy-3-methoxybenzoate
CID 45094190
N-cyclohexyl-2-[(2-ethoxybenzoyl)amino]benzamide
CID 4926381
2-methoxy-N-[4-[(2-methoxybenzoyl)amino]cyclohexyl]benzamide
CID 1235931
[2-(cyclohexylamino)-2-oxoethyl] 2,3-dimethoxybenzoate
CID 2503827
N-cyclohexyl-3-ethoxy-4-methoxybenzamide
CID 2992515
N-cycloheptyl-3-ethoxy-4-methoxybenzamide
CID 24539374
2-ethoxy-3-methoxybenzoyl chloride
CID 21314777
2,3-dimethoxy-N-(1-propylsulfonylpiperidin-4-yl)benzamide
CID 46464711

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-ethoxy-3-methoxybenzamide?
The IUPAC name of N-cyclohexyl-2-ethoxy-3-methoxybenzamide (CID 2988102) is N-cyclohexyl-2-ethoxy-3-methoxybenzamide.
What is the SMILES notation for N-cyclohexyl-2-ethoxy-3-methoxybenzamide?
The canonical SMILES for N-cyclohexyl-2-ethoxy-3-methoxybenzamide is CCOc1c(OC)cccc1C(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-ethoxy-3-methoxybenzamide?
The InChIKey is XFFPVROHAUPHDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO3/c1-3-20-15-13(10-7-11-14(15)19-2)16(18)17-12-8-5-4-6-9-12/h7,10-12H,3-6,8-9H2,1-2H3,(H,17,18).
What are the key properties of N-cyclohexyl-2-ethoxy-3-methoxybenzamide?
N-cyclohexyl-2-ethoxy-3-methoxybenzamide has a molecular weight of 277.36 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-ethoxy-3-methoxybenzamide is sourced from PubChem (CID 2988102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).