2-chloro-2-phenylhexan-1-amine;silane

C12H22ClNSi — CID 174268872

IUPAC2-chloro-2-phenylhexan-1-amine;silane
SMILESCCCCC(Cl)(CN)c1ccccc1.[SiH4]
InChIInChI=1S/C12H18ClN.H4Si/c1-2-3-9-12(13,10-14)11-7-5-4-6-8-11;/h4-8H,2-3,9-10,14H2,1H3;1H4
InChIKeyOYCAPIYTPXBTHM-UHFFFAOYSA-N
MW243.85 g/mol
LogP1.82
Rot. Bonds5

About 2-chloro-2-phenylhexan-1-amine;silane

2-chloro-2-phenylhexan-1-amine;silane (PubChem CID 174268872) has the molecular formula C12H22ClNSi and a molecular weight of 243.85 g/mol. Its IUPAC name is 2-chloro-2-phenylhexan-1-amine;silane.

Molecular Properties

Compound Name2-chloro-2-phenylhexan-1-amine;silane
PubChem CID174268872
Molecular FormulaC12H22ClNSi
Molecular Weight243.85 g/mol
Exact Mass243.12
IUPAC Name2-chloro-2-phenylhexan-1-amine;silane
SMILESCCCCC(Cl)(CN)c1ccccc1.[SiH4]
InChIInChI=1S/C12H18ClN.H4Si/c1-2-3-9-12(13,10-14)11-7-5-4-6-8-11;/h4-8H,2-3,9-10,14H2,1H3;1H4
InChIKeyOYCAPIYTPXBTHM-UHFFFAOYSA-N
XLogP1.82
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.85
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,1-diphenylpentan-1-amine
CID 10263654
(2S)-2-phenylhexan-2-amine
CID 10889241
(2R)-2-phenylhexan-2-amine;hydrochloride
CID 53487309
1,1-diphenylhexan-1-amine
CID 20568221
(5,6-diethyl-6-phenyldecan-5-yl)benzene
CID 10545838
1-chloro-1-phenylbutan-1-amine
CID 174514762
1-chloro-4-[1-(4-chlorophenyl)-1-phenylpentyl]benzene
CID 57254584
2-fluoro-2-phenyldodecan-1-amine
CID 115918070
methyl 2-(aminomethyl)-2-phenylhexanoate
CID 106489213
1,1-diphenyldodecan-1-amine
CID 19925745
(3,3-dimethyl-2-phenylheptan-2-yl)benzene
CID 139749587
[(3S)-2,2,3-trimethylheptan-3-yl]benzene
CID 158389582

Frequently Asked Questions

What is the IUPAC name of 2-chloro-2-phenylhexan-1-amine;silane?
The IUPAC name of 2-chloro-2-phenylhexan-1-amine;silane (CID 174268872) is 2-chloro-2-phenylhexan-1-amine;silane.
What is the SMILES notation for 2-chloro-2-phenylhexan-1-amine;silane?
The canonical SMILES for 2-chloro-2-phenylhexan-1-amine;silane is CCCCC(Cl)(CN)c1ccccc1.[SiH4].
What is the InChIKey of 2-chloro-2-phenylhexan-1-amine;silane?
The InChIKey is OYCAPIYTPXBTHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18ClN.H4Si/c1-2-3-9-12(13,10-14)11-7-5-4-6-8-11;/h4-8H,2-3,9-10,14H2,1H3;1H4.
What are the key properties of 2-chloro-2-phenylhexan-1-amine;silane?
2-chloro-2-phenylhexan-1-amine;silane has a molecular weight of 243.85 g/mol, XLogP of 1.82, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-2-phenylhexan-1-amine;silane is sourced from PubChem (CID 174268872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).