N-(1,3-dimethylcyclopenta-2,4-dien-1-yl)-N-dimethylsilylcyclohexanamine

C15H27NSi — CID 123358910

IUPACN-(1,3-dimethylcyclopenta-2,4-dien-1-yl)-N-dimethylsilylcyclohexanamine
SMILESCC1=CC(C)(N(C2CCCCC2)[SiH](C)C)C=C1
InChIInChI=1S/C15H27NSi/c1-13-10-11-15(2,12-13)16(17(3)4)14-8-6-5-7-9-14/h10-12,14,17H,5-9H2,1-4H3
InChIKeyMHHVPELFBOTSCI-UHFFFAOYSA-N
MW249.47 g/mol
LogP3.88
Rot. Bonds3

About N-(1,3-dimethylcyclopenta-2,4-dien-1-yl)-N-dimethylsilylcyclohexanamine

N-(1,3-dimethylcyclopenta-2,4-dien-1-yl)-N-dimethylsilylcyclohexanamine (PubChem CID 123358910) has the molecular formula C15H27NSi and a molecular weight of 249.47 g/mol. Its IUPAC name is N-(1,3-dimethylcyclopenta-2,4-dien-1-yl)-N-dimethylsilylcyclohexanamine.

Molecular Properties

Compound NameN-(1,3-dimethylcyclopenta-2,4-dien-1-yl)-N-dimethylsilylcyclohexanamine
PubChem CID123358910
Molecular FormulaC15H27NSi
Molecular Weight249.47 g/mol
Exact Mass249.19
IUPAC NameN-(1,3-dimethylcyclopenta-2,4-dien-1-yl)-N-dimethylsilylcyclohexanamine
SMILESCC1=CC(C)(N(C2CCCCC2)[SiH](C)C)C=C1
InChIInChI=1S/C15H27NSi/c1-13-10-11-15(2,12-13)16(17(3)4)14-8-6-5-7-9-14/h10-12,14,17H,5-9H2,1-4H3
InChIKeyMHHVPELFBOTSCI-UHFFFAOYSA-N
XLogP3.88
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.47
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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-(1,3-dimethylcyclopenta-2,4-dien-1-yl)-N-dimethylsilylcyclohexanamine?
The IUPAC name of N-(1,3-dimethylcyclopenta-2,4-dien-1-yl)-N-dimethylsilylcyclohexanamine (CID 123358910) is N-(1,3-dimethylcyclopenta-2,4-dien-1-yl)-N-dimethylsilylcyclohexanamine.
What is the SMILES notation for N-(1,3-dimethylcyclopenta-2,4-dien-1-yl)-N-dimethylsilylcyclohexanamine?
The canonical SMILES for N-(1,3-dimethylcyclopenta-2,4-dien-1-yl)-N-dimethylsilylcyclohexanamine is CC1=CC(C)(N(C2CCCCC2)[SiH](C)C)C=C1.
What is the InChIKey of N-(1,3-dimethylcyclopenta-2,4-dien-1-yl)-N-dimethylsilylcyclohexanamine?
The InChIKey is MHHVPELFBOTSCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NSi/c1-13-10-11-15(2,12-13)16(17(3)4)14-8-6-5-7-9-14/h10-12,14,17H,5-9H2,1-4H3.
What are the key properties of N-(1,3-dimethylcyclopenta-2,4-dien-1-yl)-N-dimethylsilylcyclohexanamine?
N-(1,3-dimethylcyclopenta-2,4-dien-1-yl)-N-dimethylsilylcyclohexanamine has a molecular weight of 249.47 g/mol, XLogP of 3.88, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dimethylcyclopenta-2,4-dien-1-yl)-N-dimethylsilylcyclohexanamine is sourced from PubChem (CID 123358910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).