N-cyclohexyl-4-propoxybenzamide

C16H23NO2 — CID 4938429

IUPACN-cyclohexyl-4-propoxybenzamide
SMILESCCCOc1ccc(C(=O)NC2CCCCC2)cc1
InChIInChI=1S/C16H23NO2/c1-2-12-19-15-10-8-13(9-11-15)16(18)17-14-6-4-3-5-7-14/h8-11,14H,2-7,12H2,1H3,(H,17,18)
InChIKeyMKLLOHNLZMTNKV-UHFFFAOYSA-N
MW261.37 g/mol
LogP3.54
Rot. Bonds5

About N-cyclohexyl-4-propoxybenzamide

N-cyclohexyl-4-propoxybenzamide (PubChem CID 4938429) has the molecular formula C16H23NO2 and a molecular weight of 261.37 g/mol. Its IUPAC name is N-cyclohexyl-4-propoxybenzamide.

Molecular Properties

Compound NameN-cyclohexyl-4-propoxybenzamide
PubChem CID4938429
Molecular FormulaC16H23NO2
Molecular Weight261.37 g/mol
Exact Mass261.17
IUPAC NameN-cyclohexyl-4-propoxybenzamide
SMILESCCCOc1ccc(C(=O)NC2CCCCC2)cc1
InChIInChI=1S/C16H23NO2/c1-2-12-19-15-10-8-13(9-11-15)16(18)17-14-6-4-3-5-7-14/h8-11,14H,2-7,12H2,1H3,(H,17,18)
InChIKeyMKLLOHNLZMTNKV-UHFFFAOYSA-N
XLogP3.54
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-butoxy-N-cyclobutylbenzamide
CID 71449411
4-(2-aminoethoxy)-N-cyclohexylbenzamide
CID 22362508
N-cyclohexyl-3-propoxybenzamide
CID 4960053
N-cyclopentyl-4-(3-methylbutoxy)benzamide
CID 4948351
4-N-cyclohexyl-1-N-[2-(4-methoxyphenoxy)ethyl]benzene-1,4-dicarboxamide
CID 109044769
3-[(4-propoxybenzoyl)amino]cyclopentane-1-carboxylic acid
CID 66032521
N-cyclohexyl-4-[(4-heptoxybenzoyl)carbamothioylamino]benzamide
CID 43878562
N-cyclohexyl-4-[[2-(4-hexoxyanilino)acetyl]amino]benzamide
CID 54820151
N-cyclohexyl-2-[(4-hexoxybenzoyl)amino]benzamide
CID 4933656
N-cycloheptyl-4-(2-phenylsulfanylethoxy)benzamide
CID 92677205
3-bromo-N-cyclohexyl-4-propoxybenzamide
CID 17342733
[2-(cyclohexylcarbamoylamino)-2-oxoethyl] 4-propoxybenzoate
CID 7211666

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-propoxybenzamide?
The IUPAC name of N-cyclohexyl-4-propoxybenzamide (CID 4938429) is N-cyclohexyl-4-propoxybenzamide.
What is the SMILES notation for N-cyclohexyl-4-propoxybenzamide?
The canonical SMILES for N-cyclohexyl-4-propoxybenzamide is CCCOc1ccc(C(=O)NC2CCCCC2)cc1.
What is the InChIKey of N-cyclohexyl-4-propoxybenzamide?
The InChIKey is MKLLOHNLZMTNKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c1-2-12-19-15-10-8-13(9-11-15)16(18)17-14-6-4-3-5-7-14/h8-11,14H,2-7,12H2,1H3,(H,17,18).
What are the key properties of N-cyclohexyl-4-propoxybenzamide?
N-cyclohexyl-4-propoxybenzamide has a molecular weight of 261.37 g/mol, XLogP of 3.54, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-propoxybenzamide is sourced from PubChem (CID 4938429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).