N,3-dicyclohexylpropanamide

C15H27NO — CID 759108

IUPACN,3-dicyclohexylpropanamide
SMILESO=C(CCC1CCCCC1)NC1CCCCC1
InChIInChI=1S/C15H27NO/c17-15(16-14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h13-14H,1-12H2,(H,16,17)
InChIKeyPODBQASBZJHUAC-UHFFFAOYSA-N
MW237.39 g/mol
LogP3.80
Rot. Bonds4

About N,3-dicyclohexylpropanamide

N,3-dicyclohexylpropanamide (PubChem CID 759108) has the molecular formula C15H27NO and a molecular weight of 237.39 g/mol. Its IUPAC name is N,3-dicyclohexylpropanamide.

Molecular Properties

Compound NameN,3-dicyclohexylpropanamide
PubChem CID759108
Molecular FormulaC15H27NO
Molecular Weight237.39 g/mol
Exact Mass237.21
IUPAC NameN,3-dicyclohexylpropanamide
SMILESO=C(CCC1CCCCC1)NC1CCCCC1
InChIInChI=1S/C15H27NO/c17-15(16-14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h13-14H,1-12H2,(H,16,17)
InChIKeyPODBQASBZJHUAC-UHFFFAOYSA-N
XLogP3.80
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,3-dicyclohexylpropanamide?
The IUPAC name of N,3-dicyclohexylpropanamide (CID 759108) is N,3-dicyclohexylpropanamide.
What is the SMILES notation for N,3-dicyclohexylpropanamide?
The canonical SMILES for N,3-dicyclohexylpropanamide is O=C(CCC1CCCCC1)NC1CCCCC1.
What is the InChIKey of N,3-dicyclohexylpropanamide?
The InChIKey is PODBQASBZJHUAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO/c17-15(16-14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h13-14H,1-12H2,(H,16,17).
What are the key properties of N,3-dicyclohexylpropanamide?
N,3-dicyclohexylpropanamide has a molecular weight of 237.39 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dicyclohexylpropanamide is sourced from PubChem (CID 759108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).