4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexane-1,2-diamine

C23H34N2OSi — CID 173121594

IUPAC4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexane-1,2-diamine
SMILESCC(C)(C)C(O[SiH](c1ccccc1)c1ccccc1)C1CCC(N)C(N)C1
InChIInChI=1S/C23H34N2OSi/c1-23(2,3)22(17-14-15-20(24)21(25)16-17)26-27(18-10-6-4-7-11-18)19-12-8-5-9-13-19/h4-13,17,20-22,27H,14-16,24-25H2,1-3H3
InChIKeyIDVMVRNVMPTPHQ-UHFFFAOYSA-N
MW382.62 g/mol
LogP2.41
Rot. Bonds5

About 4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexane-1,2-diamine

4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexane-1,2-diamine (PubChem CID 173121594) has the molecular formula C23H34N2OSi and a molecular weight of 382.62 g/mol. Its IUPAC name is 4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexane-1,2-diamine.

Molecular Properties

Compound Name4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexane-1,2-diamine
PubChem CID173121594
Molecular FormulaC23H34N2OSi
Molecular Weight382.62 g/mol
Exact Mass382.24
IUPAC Name4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexane-1,2-diamine
SMILESCC(C)(C)C(O[SiH](c1ccccc1)c1ccccc1)C1CCC(N)C(N)C1
InChIInChI=1S/C23H34N2OSi/c1-23(2,3)22(17-14-15-20(24)21(25)16-17)26-27(18-10-6-4-7-11-18)19-12-8-5-9-13-19/h4-13,17,20-22,27H,14-16,24-25H2,1-3H3
InChIKeyIDVMVRNVMPTPHQ-UHFFFAOYSA-N
XLogP2.41
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.62
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl N-[(1S,2S,4R)-2-amino-4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexyl]carbamate
CID 173121597
(1-cyclobutyl-2,2-dimethylpropoxy)-diphenylsilane
CID 173387668
tert-butyl 1,2-diamino-4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexane-1-carboxylate
CID 173018657
[2,2-dimethyl-1-[(2R)-thiiran-2-yl]propoxy]-diphenylsilane
CID 154162263
[(1S,2S,3S)-2,3-bis(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclobutyl]-phenylmethanone
CID 173309254
2-diphenylsilyloxy-3,3-dimethylbutanal
CID 173363396
tert-butyl 2-(1-diphenylsilyloxy-2,2-dimethylpropyl)-2,3-dihydropyrrole-1-carboxylate
CID 173493419
2,2-dimethylhexan-3-yloxy(diphenyl)silane
CID 173016744
4-(1-diphenylsilyloxy-2,2-dimethylpropyl)-1-(5-hydroxycyclooctyl)-3,3-dimethylpyrrolidin-2-one
CID 173005126
2-[2-[2-[2-[2-(2-diphenylsilyloxy-3,3-dimethylbutoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanamine
CID 173024422
4-propan-2-ylcyclohexane-1,2-diamine
CID 22415223
(1S,2R,4R)-4-[tert-butyl(diphenyl)silyl]oxycyclohexane-1,2-diamine
CID 177070919

Frequently Asked Questions

What is the IUPAC name of 4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexane-1,2-diamine?
The IUPAC name of 4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexane-1,2-diamine (CID 173121594) is 4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexane-1,2-diamine.
What is the SMILES notation for 4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexane-1,2-diamine?
The canonical SMILES for 4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexane-1,2-diamine is CC(C)(C)C(O[SiH](c1ccccc1)c1ccccc1)C1CCC(N)C(N)C1.
What is the InChIKey of 4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexane-1,2-diamine?
The InChIKey is IDVMVRNVMPTPHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H34N2OSi/c1-23(2,3)22(17-14-15-20(24)21(25)16-17)26-27(18-10-6-4-7-11-18)19-12-8-5-9-13-19/h4-13,17,20-22,27H,14-16,24-25H2,1-3H3.
What are the key properties of 4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexane-1,2-diamine?
4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexane-1,2-diamine has a molecular weight of 382.62 g/mol, XLogP of 2.41, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-diphenylsilyloxy-2,2-dimethylpropyl)cyclohexane-1,2-diamine is sourced from PubChem (CID 173121594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).