N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,4-dien-1-yl)silyl]cyclohexanamine

C17H31NSi — CID 135850268

IUPACN-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,4-dien-1-yl)silyl]cyclohexanamine
SMILESCC1=C(C)C(C)C(C)=C1[Si](C)(C)NC1CCCCC1
InChIInChI=1S/C17H31NSi/c1-12-13(2)15(4)17(14(12)3)19(5,6)18-16-10-8-7-9-11-16/h12,16,18H,7-11H2,1-6H3
InChIKeyBZXZPSIRKWWQIP-UHFFFAOYSA-N
MW277.53 g/mol
LogP4.96
Rot. Bonds3

About N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,4-dien-1-yl)silyl]cyclohexanamine

N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,4-dien-1-yl)silyl]cyclohexanamine (PubChem CID 135850268) has the molecular formula C17H31NSi and a molecular weight of 277.53 g/mol. Its IUPAC name is N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,4-dien-1-yl)silyl]cyclohexanamine.

Molecular Properties

Compound NameN-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,4-dien-1-yl)silyl]cyclohexanamine
PubChem CID135850268
Molecular FormulaC17H31NSi
Molecular Weight277.53 g/mol
Exact Mass277.22
IUPAC NameN-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,4-dien-1-yl)silyl]cyclohexanamine
SMILESCC1=C(C)C(C)C(C)=C1[Si](C)(C)NC1CCCCC1
InChIInChI=1S/C17H31NSi/c1-12-13(2)15(4)17(14(12)3)19(5,6)18-16-10-8-7-9-11-16/h12,16,18H,7-11H2,1-6H3
InChIKeyBZXZPSIRKWWQIP-UHFFFAOYSA-N
XLogP4.96
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.53
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-N,4-N-bis[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,3-dien-1-yl)silyl]cyclohexane-1,4-diamine;bis(titanium(2+));tetrachloride
CID 173284026
N-trimethylsilylcyclohexanamine
CID 521683
N-[dimethoxy(methyl)silyl]cyclohexanamine
CID 68957106
N-[dimethyl-(2,3,4-trimethylcyclopentyl)silyl]cyclododecanamine
CID 165155302
CID 70306336
CID 70306336
N-methylcyclohexanamine
CID 7514
N-methylcyclotetradecanamine
CID 59468246
N-cyclohexyl-N-deuteriocyclohexanamine
CID 175910061
N-methylcyclohexanamine;dihydrochloride
CID 140514199
N-cyclohexylcyclohexanamine;ethane
CID 67925930
N-[(4-methylthiophen-3-yl)methyl]cycloheptanamine
CID 79803205
N-cyclopentyl-2-(2-methyl-4-pyridinyl)acetamide
CID 21278987

Frequently Asked Questions

What is the IUPAC name of N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,4-dien-1-yl)silyl]cyclohexanamine?
The IUPAC name of N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,4-dien-1-yl)silyl]cyclohexanamine (CID 135850268) is N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,4-dien-1-yl)silyl]cyclohexanamine.
What is the SMILES notation for N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,4-dien-1-yl)silyl]cyclohexanamine?
The canonical SMILES for N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,4-dien-1-yl)silyl]cyclohexanamine is CC1=C(C)C(C)C(C)=C1[Si](C)(C)NC1CCCCC1.
What is the InChIKey of N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,4-dien-1-yl)silyl]cyclohexanamine?
The InChIKey is BZXZPSIRKWWQIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31NSi/c1-12-13(2)15(4)17(14(12)3)19(5,6)18-16-10-8-7-9-11-16/h12,16,18H,7-11H2,1-6H3.
What are the key properties of N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,4-dien-1-yl)silyl]cyclohexanamine?
N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,4-dien-1-yl)silyl]cyclohexanamine has a molecular weight of 277.53 g/mol, XLogP of 4.96, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,4-dien-1-yl)silyl]cyclohexanamine is sourced from PubChem (CID 135850268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).