4-[tert-butyl(diphenyl)silyl]oxy-2-methylcyclopentan-1-amine

C22H31NOSi — CID 142751894

IUPAC4-[tert-butyl(diphenyl)silyl]oxy-2-methylcyclopentan-1-amine
SMILESCC1CC(O[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)CC1N
InChIInChI=1S/C22H31NOSi/c1-17-15-18(16-21(17)23)24-25(22(2,3)4,19-11-7-5-8-12-19)20-13-9-6-10-14-20/h5-14,17-18,21H,15-16,23H2,1-4H3
InChIKeyAUCREBGBLRWRLP-UHFFFAOYSA-N
MW353.58 g/mol
LogP3.69
Rot. Bonds4

About 4-[tert-butyl(diphenyl)silyl]oxy-2-methylcyclopentan-1-amine

4-[tert-butyl(diphenyl)silyl]oxy-2-methylcyclopentan-1-amine (PubChem CID 142751894) has the molecular formula C22H31NOSi and a molecular weight of 353.58 g/mol. Its IUPAC name is 4-[tert-butyl(diphenyl)silyl]oxy-2-methylcyclopentan-1-amine.

Molecular Properties

Compound Name4-[tert-butyl(diphenyl)silyl]oxy-2-methylcyclopentan-1-amine
PubChem CID142751894
Molecular FormulaC22H31NOSi
Molecular Weight353.58 g/mol
Exact Mass353.22
IUPAC Name4-[tert-butyl(diphenyl)silyl]oxy-2-methylcyclopentan-1-amine
SMILESCC1CC(O[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)CC1N
InChIInChI=1S/C22H31NOSi/c1-17-15-18(16-21(17)23)24-25(22(2,3)4,19-11-7-5-8-12-19)20-13-9-6-10-14-20/h5-14,17-18,21H,15-16,23H2,1-4H3
InChIKeyAUCREBGBLRWRLP-UHFFFAOYSA-N
XLogP3.69
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.58
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-[tert-butyl(diphenyl)silyl]oxycyclopentane-1,2-diamine;4-[tert-butyl(diphenyl)silyl]oxycyclopentane-1,2-diol
CID 159197453
(1S,2R,4R)-4-[tert-butyl(diphenyl)silyl]oxycyclohexane-1,2-diamine
CID 177070919
3-bicyclo[3.1.0]hexanyloxy-tert-butyl-diphenylsilane
CID 154401251
3-[tert-butyl(diphenyl)silyl]oxycyclobutan-1-ol
CID 59414974
(3-bromocyclobutyl)oxy-tert-butyl-diphenylsilane
CID 142577121
tert-butyl-[(1R,2R)-2,4-dimethylcyclopentyl]oxy-diphenylsilane
CID 158022147
tert-butyl-[[(1R,5S)-8-oxabicyclo[3.2.1]oct-6-en-3-yl]oxy]-diphenylsilane
CID 102008296
tert-butyl-cyclopent-3-en-1-yloxy-diphenylsilane
CID 11347853
2-[(2R,6R)-4-[tert-butyl(diphenyl)silyl]oxy-6-(2-hydroxypropan-2-yl)oxan-2-yl]propan-2-ol
CID 11977280
1-[(1R,5R)-3-[tert-butyl(diphenyl)silyl]oxy-6-bicyclo[3.1.0]hexanyl]ethanone
CID 129323384
cis-methyl (3S,5R)-3,5-bis[[tert-butyl(diphenyl)silyl]oxy]cyclohexane-1-carboxylate
CID 58715061
methyl 3,5-bis[[tert-butyl(diphenyl)silyl]oxy]cyclohexane-1-carboxylate
CID 21062599

Frequently Asked Questions

What is the IUPAC name of 4-[tert-butyl(diphenyl)silyl]oxy-2-methylcyclopentan-1-amine?
The IUPAC name of 4-[tert-butyl(diphenyl)silyl]oxy-2-methylcyclopentan-1-amine (CID 142751894) is 4-[tert-butyl(diphenyl)silyl]oxy-2-methylcyclopentan-1-amine.
What is the SMILES notation for 4-[tert-butyl(diphenyl)silyl]oxy-2-methylcyclopentan-1-amine?
The canonical SMILES for 4-[tert-butyl(diphenyl)silyl]oxy-2-methylcyclopentan-1-amine is CC1CC(O[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)CC1N.
What is the InChIKey of 4-[tert-butyl(diphenyl)silyl]oxy-2-methylcyclopentan-1-amine?
The InChIKey is AUCREBGBLRWRLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H31NOSi/c1-17-15-18(16-21(17)23)24-25(22(2,3)4,19-11-7-5-8-12-19)20-13-9-6-10-14-20/h5-14,17-18,21H,15-16,23H2,1-4H3.
What are the key properties of 4-[tert-butyl(diphenyl)silyl]oxy-2-methylcyclopentan-1-amine?
4-[tert-butyl(diphenyl)silyl]oxy-2-methylcyclopentan-1-amine has a molecular weight of 353.58 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[tert-butyl(diphenyl)silyl]oxy-2-methylcyclopentan-1-amine is sourced from PubChem (CID 142751894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).