N-cyclohexyl-N-[(dicyclohexylamino)-bis(ethylamino)silyl]cyclohexanamine

C28H56N4Si — CID 66628427

IUPACN-cyclohexyl-N-[(dicyclohexylamino)-bis(ethylamino)silyl]cyclohexanamine
SMILESCCN[Si](NCC)(N(C1CCCCC1)C1CCCCC1)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C28H56N4Si/c1-3-29-33(30-4-2,31(25-17-9-5-10-18-25)26-19-11-6-12-20-26)32(27-21-13-7-14-22-27)28-23-15-8-16-24-28/h25-30H,3-24H2,1-2H3
InChIKeyFTCBMZFUZKRLEG-UHFFFAOYSA-N
MW476.87 g/mol
LogP6.58
Rot. Bonds10

About N-cyclohexyl-N-[(dicyclohexylamino)-bis(ethylamino)silyl]cyclohexanamine

N-cyclohexyl-N-[(dicyclohexylamino)-bis(ethylamino)silyl]cyclohexanamine (PubChem CID 66628427) has the molecular formula C28H56N4Si and a molecular weight of 476.87 g/mol. Its IUPAC name is N-cyclohexyl-N-[(dicyclohexylamino)-bis(ethylamino)silyl]cyclohexanamine.

Molecular Properties

Compound NameN-cyclohexyl-N-[(dicyclohexylamino)-bis(ethylamino)silyl]cyclohexanamine
PubChem CID66628427
Molecular FormulaC28H56N4Si
Molecular Weight476.87 g/mol
Exact Mass476.43
IUPAC NameN-cyclohexyl-N-[(dicyclohexylamino)-bis(ethylamino)silyl]cyclohexanamine
SMILESCCN[Si](NCC)(N(C1CCCCC1)C1CCCCC1)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C28H56N4Si/c1-3-29-33(30-4-2,31(25-17-9-5-10-18-25)26-19-11-6-12-20-26)32(27-21-13-7-14-22-27)28-23-15-8-16-24-28/h25-30H,3-24H2,1-2H3
InChIKeyFTCBMZFUZKRLEG-UHFFFAOYSA-N
XLogP6.58
TPSA30.54 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500476.87
LogP ≤ 56.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-[(dicyclohexylamino)-bis(ethylamino)silyl]cyclohexanamine?
The IUPAC name of N-cyclohexyl-N-[(dicyclohexylamino)-bis(ethylamino)silyl]cyclohexanamine (CID 66628427) is N-cyclohexyl-N-[(dicyclohexylamino)-bis(ethylamino)silyl]cyclohexanamine.
What is the SMILES notation for N-cyclohexyl-N-[(dicyclohexylamino)-bis(ethylamino)silyl]cyclohexanamine?
The canonical SMILES for N-cyclohexyl-N-[(dicyclohexylamino)-bis(ethylamino)silyl]cyclohexanamine is CCN[Si](NCC)(N(C1CCCCC1)C1CCCCC1)N(C1CCCCC1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-[(dicyclohexylamino)-bis(ethylamino)silyl]cyclohexanamine?
The InChIKey is FTCBMZFUZKRLEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H56N4Si/c1-3-29-33(30-4-2,31(25-17-9-5-10-18-25)26-19-11-6-12-20-26)32(27-21-13-7-14-22-27)28-23-15-8-16-24-28/h25-30H,3-24H2,1-2H3.
What are the key properties of N-cyclohexyl-N-[(dicyclohexylamino)-bis(ethylamino)silyl]cyclohexanamine?
N-cyclohexyl-N-[(dicyclohexylamino)-bis(ethylamino)silyl]cyclohexanamine has a molecular weight of 476.87 g/mol, XLogP of 6.58, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-[(dicyclohexylamino)-bis(ethylamino)silyl]cyclohexanamine is sourced from PubChem (CID 66628427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).