N-cyclohexylazocane-1-carboxamide

C14H26N2O — CID 3245060

IUPACN-cyclohexylazocane-1-carboxamide
SMILESO=C(NC1CCCCC1)N1CCCCCCC1
InChIInChI=1S/C14H26N2O/c17-14(15-13-9-5-4-6-10-13)16-11-7-2-1-3-8-12-16/h13H,1-12H2,(H,15,17)
InChIKeyOOCFUXZSESFZOD-UHFFFAOYSA-N
MW238.37 g/mol
LogP3.29
Rot. Bonds1

About N-cyclohexylazocane-1-carboxamide

N-cyclohexylazocane-1-carboxamide (PubChem CID 3245060) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is N-cyclohexylazocane-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexylazocane-1-carboxamide
PubChem CID3245060
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC NameN-cyclohexylazocane-1-carboxamide
SMILESO=C(NC1CCCCC1)N1CCCCCCC1
InChIInChI=1S/C14H26N2O/c17-14(15-13-9-5-4-6-10-13)16-11-7-2-1-3-8-12-16/h13H,1-12H2,(H,15,17)
InChIKeyOOCFUXZSESFZOD-UHFFFAOYSA-N
XLogP3.29
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexylazocane-1-carboxamide?
The IUPAC name of N-cyclohexylazocane-1-carboxamide (CID 3245060) is N-cyclohexylazocane-1-carboxamide.
What is the SMILES notation for N-cyclohexylazocane-1-carboxamide?
The canonical SMILES for N-cyclohexylazocane-1-carboxamide is O=C(NC1CCCCC1)N1CCCCCCC1.
What is the InChIKey of N-cyclohexylazocane-1-carboxamide?
The InChIKey is OOCFUXZSESFZOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c17-14(15-13-9-5-4-6-10-13)16-11-7-2-1-3-8-12-16/h13H,1-12H2,(H,15,17).
What are the key properties of N-cyclohexylazocane-1-carboxamide?
N-cyclohexylazocane-1-carboxamide has a molecular weight of 238.37 g/mol, XLogP of 3.29, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexylazocane-1-carboxamide is sourced from PubChem (CID 3245060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).