5-chloro-2-cyclopentyloxy-N-(4-hydroxycyclohexyl)benzamide

C18H24ClNO3 — CID 111778241

IUPAC5-chloro-2-cyclopentyloxy-N-(4-hydroxycyclohexyl)benzamide
SMILESO=C(NC1CCC(O)CC1)c1cc(Cl)ccc1OC1CCCC1
InChIInChI=1S/C18H24ClNO3/c19-12-5-10-17(23-15-3-1-2-4-15)16(11-12)18(22)20-13-6-8-14(21)9-7-13/h5,10-11,13-15,21H,1-4,6-9H2,(H,20,22)
InChIKeyWOYOPYDECIKXRI-UHFFFAOYSA-N
MW337.85 g/mol
LogP3.69
Rot. Bonds4

About 5-chloro-2-cyclopentyloxy-N-(4-hydroxycyclohexyl)benzamide

5-chloro-2-cyclopentyloxy-N-(4-hydroxycyclohexyl)benzamide (PubChem CID 111778241) has the molecular formula C18H24ClNO3 and a molecular weight of 337.85 g/mol. Its IUPAC name is 5-chloro-2-cyclopentyloxy-N-(4-hydroxycyclohexyl)benzamide.

Molecular Properties

Compound Name5-chloro-2-cyclopentyloxy-N-(4-hydroxycyclohexyl)benzamide
PubChem CID111778241
Molecular FormulaC18H24ClNO3
Molecular Weight337.85 g/mol
Exact Mass337.14
IUPAC Name5-chloro-2-cyclopentyloxy-N-(4-hydroxycyclohexyl)benzamide
SMILESO=C(NC1CCC(O)CC1)c1cc(Cl)ccc1OC1CCCC1
InChIInChI=1S/C18H24ClNO3/c19-12-5-10-17(23-15-3-1-2-4-15)16(11-12)18(22)20-13-6-8-14(21)9-7-13/h5,10-11,13-15,21H,1-4,6-9H2,(H,20,22)
InChIKeyWOYOPYDECIKXRI-UHFFFAOYSA-N
XLogP3.69
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.85
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-cyclopentyloxy-N-(4-hydroxycyclohexyl)benzamide?
The IUPAC name of 5-chloro-2-cyclopentyloxy-N-(4-hydroxycyclohexyl)benzamide (CID 111778241) is 5-chloro-2-cyclopentyloxy-N-(4-hydroxycyclohexyl)benzamide.
What is the SMILES notation for 5-chloro-2-cyclopentyloxy-N-(4-hydroxycyclohexyl)benzamide?
The canonical SMILES for 5-chloro-2-cyclopentyloxy-N-(4-hydroxycyclohexyl)benzamide is O=C(NC1CCC(O)CC1)c1cc(Cl)ccc1OC1CCCC1.
What is the InChIKey of 5-chloro-2-cyclopentyloxy-N-(4-hydroxycyclohexyl)benzamide?
The InChIKey is WOYOPYDECIKXRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24ClNO3/c19-12-5-10-17(23-15-3-1-2-4-15)16(11-12)18(22)20-13-6-8-14(21)9-7-13/h5,10-11,13-15,21H,1-4,6-9H2,(H,20,22).
What are the key properties of 5-chloro-2-cyclopentyloxy-N-(4-hydroxycyclohexyl)benzamide?
5-chloro-2-cyclopentyloxy-N-(4-hydroxycyclohexyl)benzamide has a molecular weight of 337.85 g/mol, XLogP of 3.69, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-cyclopentyloxy-N-(4-hydroxycyclohexyl)benzamide is sourced from PubChem (CID 111778241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).