N,N'-dicyclohexylpentanediamide

C17H30N2O2 — CID 730721

IUPACN,N'-dicyclohexylpentanediamide
SMILESO=C(CCCC(=O)NC1CCCCC1)NC1CCCCC1
InChIInChI=1S/C17H30N2O2/c20-16(18-14-8-3-1-4-9-14)12-7-13-17(21)19-15-10-5-2-6-11-15/h14-15H,1-13H2,(H,18,20)(H,19,21)
InChIKeyJUCPCSUERQHDQB-UHFFFAOYSA-N
MW294.44 g/mol
LogP3.05
Rot. Bonds6

About N,N'-dicyclohexylpentanediamide

N,N'-dicyclohexylpentanediamide (PubChem CID 730721) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is N,N'-dicyclohexylpentanediamide.

Molecular Properties

Compound NameN,N'-dicyclohexylpentanediamide
PubChem CID730721
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC NameN,N'-dicyclohexylpentanediamide
SMILESO=C(CCCC(=O)NC1CCCCC1)NC1CCCCC1
InChIInChI=1S/C17H30N2O2/c20-16(18-14-8-3-1-4-9-14)12-7-13-17(21)19-15-10-5-2-6-11-15/h14-15H,1-13H2,(H,18,20)(H,19,21)
InChIKeyJUCPCSUERQHDQB-UHFFFAOYSA-N
XLogP3.05
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N'-dicyclohexylpentanediamide?
The IUPAC name of N,N'-dicyclohexylpentanediamide (CID 730721) is N,N'-dicyclohexylpentanediamide.
What is the SMILES notation for N,N'-dicyclohexylpentanediamide?
The canonical SMILES for N,N'-dicyclohexylpentanediamide is O=C(CCCC(=O)NC1CCCCC1)NC1CCCCC1.
What is the InChIKey of N,N'-dicyclohexylpentanediamide?
The InChIKey is JUCPCSUERQHDQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O2/c20-16(18-14-8-3-1-4-9-14)12-7-13-17(21)19-15-10-5-2-6-11-15/h14-15H,1-13H2,(H,18,20)(H,19,21).
What are the key properties of N,N'-dicyclohexylpentanediamide?
N,N'-dicyclohexylpentanediamide has a molecular weight of 294.44 g/mol, XLogP of 3.05, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dicyclohexylpentanediamide is sourced from PubChem (CID 730721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).