3-cyclohexyl-N-(4-propoxyphenyl)propanamide

C18H27NO2 — CID 110493363

IUPAC3-cyclohexyl-N-(4-propoxyphenyl)propanamide
SMILESCCCOc1ccc(NC(=O)CCC2CCCCC2)cc1
InChIInChI=1S/C18H27NO2/c1-2-14-21-17-11-9-16(10-12-17)19-18(20)13-8-15-6-4-3-5-7-15/h9-12,15H,2-8,13-14H2,1H3,(H,19,20)
InChIKeyWVWRXOVRTAWHHS-UHFFFAOYSA-N
MW289.42 g/mol
LogP4.77
Rot. Bonds7

About 3-cyclohexyl-N-(4-propoxyphenyl)propanamide

3-cyclohexyl-N-(4-propoxyphenyl)propanamide (PubChem CID 110493363) has the molecular formula C18H27NO2 and a molecular weight of 289.42 g/mol. Its IUPAC name is 3-cyclohexyl-N-(4-propoxyphenyl)propanamide.

Molecular Properties

Compound Name3-cyclohexyl-N-(4-propoxyphenyl)propanamide
PubChem CID110493363
Molecular FormulaC18H27NO2
Molecular Weight289.42 g/mol
Exact Mass289.20
IUPAC Name3-cyclohexyl-N-(4-propoxyphenyl)propanamide
SMILESCCCOc1ccc(NC(=O)CCC2CCCCC2)cc1
InChIInChI=1S/C18H27NO2/c1-2-14-21-17-11-9-16(10-12-17)19-18(20)13-8-15-6-4-3-5-7-15/h9-12,15H,2-8,13-14H2,1H3,(H,19,20)
InChIKeyWVWRXOVRTAWHHS-UHFFFAOYSA-N
XLogP4.77
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(2-cyclohexylethoxy)phenyl]propanamide
CID 17137644
3-cyclopentyl-N-(4-methoxyphenyl)propanamide
CID 835546
N-(4-butoxyphenyl)-2-cyclopentylacetamide
CID 54786143
N-[(4-butoxyphenyl)methyl]-3-cyclohexylpropanamide
CID 73253877
2-(cyclopropylmethylamino)-N-(4-propoxyphenyl)acetamide
CID 55060300
2-cyclopentyl-N-(4-hexoxyphenyl)acetamide
CID 54786135
3-chloro-N-(4-propoxyphenyl)propanamide
CID 62329515
3-cyclohexyl-N-(4-sulfanylphenyl)propanamide
CID 27125888
N-(4-butylphenyl)-3-cyclopentylpropanamide
CID 4076618
N-[[4-(2-cyclohexylethoxy)phenyl]carbamothioyl]hexanamide
CID 17137889
1-cyclopentyl-3-(4-propoxyphenyl)urea
CID 110774502
N-[[4-(2-cyclohexylethoxy)phenyl]carbamothioyl]tetradecanamide
CID 54791321

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-N-(4-propoxyphenyl)propanamide?
The IUPAC name of 3-cyclohexyl-N-(4-propoxyphenyl)propanamide (CID 110493363) is 3-cyclohexyl-N-(4-propoxyphenyl)propanamide.
What is the SMILES notation for 3-cyclohexyl-N-(4-propoxyphenyl)propanamide?
The canonical SMILES for 3-cyclohexyl-N-(4-propoxyphenyl)propanamide is CCCOc1ccc(NC(=O)CCC2CCCCC2)cc1.
What is the InChIKey of 3-cyclohexyl-N-(4-propoxyphenyl)propanamide?
The InChIKey is WVWRXOVRTAWHHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO2/c1-2-14-21-17-11-9-16(10-12-17)19-18(20)13-8-15-6-4-3-5-7-15/h9-12,15H,2-8,13-14H2,1H3,(H,19,20).
What are the key properties of 3-cyclohexyl-N-(4-propoxyphenyl)propanamide?
3-cyclohexyl-N-(4-propoxyphenyl)propanamide has a molecular weight of 289.42 g/mol, XLogP of 4.77, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-N-(4-propoxyphenyl)propanamide is sourced from PubChem (CID 110493363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).