N-cyclohexyl-2-(propanoylamino)benzamide

C16H22N2O2 — CID 974692

IUPACN-cyclohexyl-2-(propanoylamino)benzamide
SMILESCCC(=O)Nc1ccccc1C(=O)NC1CCCCC1
InChIInChI=1S/C16H22N2O2/c1-2-15(19)18-14-11-7-6-10-13(14)16(20)17-12-8-4-3-5-9-12/h6-7,10-12H,2-5,8-9H2,1H3,(H,17,20)(H,18,19)
InChIKeyPWIYNYQZCMUDNH-UHFFFAOYSA-N
MW274.36 g/mol
LogP3.10
Rot. Bonds4

About N-cyclohexyl-2-(propanoylamino)benzamide

N-cyclohexyl-2-(propanoylamino)benzamide (PubChem CID 974692) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-cyclohexyl-2-(propanoylamino)benzamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(propanoylamino)benzamide
PubChem CID974692
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC NameN-cyclohexyl-2-(propanoylamino)benzamide
SMILESCCC(=O)Nc1ccccc1C(=O)NC1CCCCC1
InChIInChI=1S/C16H22N2O2/c1-2-15(19)18-14-11-7-6-10-13(14)16(20)17-12-8-4-3-5-9-12/h6-7,10-12H,2-5,8-9H2,1H3,(H,17,20)(H,18,19)
InChIKeyPWIYNYQZCMUDNH-UHFFFAOYSA-N
XLogP3.10
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(propanoylamino)benzamide?
The IUPAC name of N-cyclohexyl-2-(propanoylamino)benzamide (CID 974692) is N-cyclohexyl-2-(propanoylamino)benzamide.
What is the SMILES notation for N-cyclohexyl-2-(propanoylamino)benzamide?
The canonical SMILES for N-cyclohexyl-2-(propanoylamino)benzamide is CCC(=O)Nc1ccccc1C(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(propanoylamino)benzamide?
The InChIKey is PWIYNYQZCMUDNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-2-15(19)18-14-11-7-6-10-13(14)16(20)17-12-8-4-3-5-9-12/h6-7,10-12H,2-5,8-9H2,1H3,(H,17,20)(H,18,19).
What are the key properties of N-cyclohexyl-2-(propanoylamino)benzamide?
N-cyclohexyl-2-(propanoylamino)benzamide has a molecular weight of 274.36 g/mol, XLogP of 3.10, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(propanoylamino)benzamide is sourced from PubChem (CID 974692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).