N-cyclohexyl-3,4-diethoxybenzamide

C17H25NO3 — CID 917356

IUPACN-cyclohexyl-3,4-diethoxybenzamide
SMILESCCOc1ccc(C(=O)NC2CCCCC2)cc1OCC
InChIInChI=1S/C17H25NO3/c1-3-20-15-11-10-13(12-16(15)21-4-2)17(19)18-14-8-6-5-7-9-14/h10-12,14H,3-9H2,1-2H3,(H,18,19)
InChIKeyDRGBDFGRKAYPHK-UHFFFAOYSA-N
MW291.39 g/mol
LogP3.55
Rot. Bonds6

About N-cyclohexyl-3,4-diethoxybenzamide

N-cyclohexyl-3,4-diethoxybenzamide (PubChem CID 917356) has the molecular formula C17H25NO3 and a molecular weight of 291.39 g/mol. Its IUPAC name is N-cyclohexyl-3,4-diethoxybenzamide.

Molecular Properties

Compound NameN-cyclohexyl-3,4-diethoxybenzamide
PubChem CID917356
Molecular FormulaC17H25NO3
Molecular Weight291.39 g/mol
Exact Mass291.18
IUPAC NameN-cyclohexyl-3,4-diethoxybenzamide
SMILESCCOc1ccc(C(=O)NC2CCCCC2)cc1OCC
InChIInChI=1S/C17H25NO3/c1-3-20-15-11-10-13(12-16(15)21-4-2)17(19)18-14-8-6-5-7-9-14/h10-12,14H,3-9H2,1-2H3,(H,18,19)
InChIKeyDRGBDFGRKAYPHK-UHFFFAOYSA-N
XLogP3.55
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-3-ethoxy-4-methoxybenzamide
CID 2992515
N-cycloheptyl-3-ethoxy-4-methoxybenzamide
CID 24539374
3-amino-N-cyclohexyl-4-ethoxybenzamide
CID 28689929
N-[2-(cyclopentylamino)-2-oxoethyl]-3,4-diethoxybenzamide
CID 26697465
N-cyclohexyl-4-[(3-ethoxy-4-methoxybenzoyl)amino]-3-methylbenzamide
CID 55879424
cis-(1S,3R)-3-[(3,4-diethoxybenzoyl)amino]cyclopentane-1-carboxylic acid
CID 120674848
N-(4-aminocyclohexyl)-3-ethoxy-4-propoxybenzamide
CID 119477535
2-[2-ethoxy-4-(oxan-4-ylcarbamoyl)phenoxy]acetic acid
CID 122135254
3-ethoxy-N-piperidin-4-yl-4-propoxybenzamide;hydrochloride
CID 119388905
N'-(cyclohexanecarbonyl)-3,4-diethoxybenzohydrazide
CID 912683
N-cyclohexyl-3,4-dimethoxybenzamide;hydrochloride
CID 67897205
N-(2-cyclohexyl-2-hydroxyethyl)-3,4-diethoxybenzamide
CID 90498823

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3,4-diethoxybenzamide?
The IUPAC name of N-cyclohexyl-3,4-diethoxybenzamide (CID 917356) is N-cyclohexyl-3,4-diethoxybenzamide.
What is the SMILES notation for N-cyclohexyl-3,4-diethoxybenzamide?
The canonical SMILES for N-cyclohexyl-3,4-diethoxybenzamide is CCOc1ccc(C(=O)NC2CCCCC2)cc1OCC.
What is the InChIKey of N-cyclohexyl-3,4-diethoxybenzamide?
The InChIKey is DRGBDFGRKAYPHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO3/c1-3-20-15-11-10-13(12-16(15)21-4-2)17(19)18-14-8-6-5-7-9-14/h10-12,14H,3-9H2,1-2H3,(H,18,19).
What are the key properties of N-cyclohexyl-3,4-diethoxybenzamide?
N-cyclohexyl-3,4-diethoxybenzamide has a molecular weight of 291.39 g/mol, XLogP of 3.55, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3,4-diethoxybenzamide is sourced from PubChem (CID 917356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).