(6-chloro-5-phenylmethoxy-2-pyridinyl)methoxy-tri(propan-2-yl)silane

C22H32ClNO2Si — CID 131746417

IUPAC(6-chloro-5-phenylmethoxy-2-pyridinyl)methoxy-tri(propan-2-yl)silane
SMILESCC(C)[Si](OCc1ccc(OCc2ccccc2)c(Cl)n1)(C(C)C)C(C)C
InChIInChI=1S/C22H32ClNO2Si/c1-16(2)27(17(3)4,18(5)6)26-15-20-12-13-21(22(23)24-20)25-14-19-10-8-7-9-11-19/h7-13,16-18H,14-15H2,1-6H3
InChIKeyFWHIVGGACFPEFJ-UHFFFAOYSA-N
MW406.04 g/mol
LogP7.01
Rot. Bonds9

About (6-chloro-5-phenylmethoxy-2-pyridinyl)methoxy-tri(propan-2-yl)silane

(6-chloro-5-phenylmethoxy-2-pyridinyl)methoxy-tri(propan-2-yl)silane (PubChem CID 131746417) has the molecular formula C22H32ClNO2Si and a molecular weight of 406.04 g/mol. Its IUPAC name is (6-chloro-5-phenylmethoxy-2-pyridinyl)methoxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Name(6-chloro-5-phenylmethoxy-2-pyridinyl)methoxy-tri(propan-2-yl)silane
PubChem CID131746417
Molecular FormulaC22H32ClNO2Si
Molecular Weight406.04 g/mol
Exact Mass405.19
IUPAC Name(6-chloro-5-phenylmethoxy-2-pyridinyl)methoxy-tri(propan-2-yl)silane
SMILESCC(C)[Si](OCc1ccc(OCc2ccccc2)c(Cl)n1)(C(C)C)C(C)C
InChIInChI=1S/C22H32ClNO2Si/c1-16(2)27(17(3)4,18(5)6)26-15-20-12-13-21(22(23)24-20)25-14-19-10-8-7-9-11-19/h7-13,16-18H,14-15H2,1-6H3
InChIKeyFWHIVGGACFPEFJ-UHFFFAOYSA-N
XLogP7.01
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500406.04
LogP ≤ 57.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze (6-chloro-5-phenylmethoxy-2-pyridinyl)methoxy-tri(propan-2-yl)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(6-phenylmethoxy-5-propoxy-2-pyridinyl)methoxy-tri(propan-2-yl)silane
CID 59300056
phosphane;triphenyl-[[4-[tri(propan-2-yl)silyloxymethyl]phenyl]methyl]phosphanium;bromide
CID 174764282
(2R)-1-[6-chloro-5-[(2,6-dichlorophenyl)methoxy]-2-pyridinyl]propan-2-amine
CID 59077089
[2,6-dimethyl-4-tri(propan-2-yl)silyloxyphenyl]-(4-phenylmethoxy-3-propan-2-ylphenyl)methanol
CID 175768889
2-chloro-3-ethyl-4,6-bis(phenylmethoxy)pyridine
CID 89421768
2-(bromomethyl)-4-chloro-1-phenylmethoxybenzene;ethane
CID 143249325
(6-methyl-3-phenylmethoxy-2-pyridinyl)methanamine
CID 58869463
1-(5-chloro-2-phenylmethoxyphenyl)-N-methylethanamine
CID 62073023
4-phenylmethoxy-3-propan-2-ylbenzenesulfonyl chloride
CID 43247067
6-bromo-N-methyl-5-phenylmethoxypyridin-2-amine
CID 167449160
N-[1-(3-chloro-4-phenylmethoxyphenyl)ethyl]propan-1-amine
CID 63533463
4-chloro-6-methoxy-7-phenylmethoxyquinazoline
CID 10661998

Frequently Asked Questions

What is the IUPAC name of (6-chloro-5-phenylmethoxy-2-pyridinyl)methoxy-tri(propan-2-yl)silane?
The IUPAC name of (6-chloro-5-phenylmethoxy-2-pyridinyl)methoxy-tri(propan-2-yl)silane (CID 131746417) is (6-chloro-5-phenylmethoxy-2-pyridinyl)methoxy-tri(propan-2-yl)silane.
What is the SMILES notation for (6-chloro-5-phenylmethoxy-2-pyridinyl)methoxy-tri(propan-2-yl)silane?
The canonical SMILES for (6-chloro-5-phenylmethoxy-2-pyridinyl)methoxy-tri(propan-2-yl)silane is CC(C)[Si](OCc1ccc(OCc2ccccc2)c(Cl)n1)(C(C)C)C(C)C.
What is the InChIKey of (6-chloro-5-phenylmethoxy-2-pyridinyl)methoxy-tri(propan-2-yl)silane?
The InChIKey is FWHIVGGACFPEFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32ClNO2Si/c1-16(2)27(17(3)4,18(5)6)26-15-20-12-13-21(22(23)24-20)25-14-19-10-8-7-9-11-19/h7-13,16-18H,14-15H2,1-6H3.
What are the key properties of (6-chloro-5-phenylmethoxy-2-pyridinyl)methoxy-tri(propan-2-yl)silane?
(6-chloro-5-phenylmethoxy-2-pyridinyl)methoxy-tri(propan-2-yl)silane has a molecular weight of 406.04 g/mol, XLogP of 7.01, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloro-5-phenylmethoxy-2-pyridinyl)methoxy-tri(propan-2-yl)silane is sourced from PubChem (CID 131746417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).