N-(chloro-methyl-phenylsilyl)propan-2-amine

C10H16ClNSi — CID 142550256

IUPACN-(chloro-methyl-phenylsilyl)propan-2-amine
SMILESCC(C)N[Si](C)(Cl)c1ccccc1
InChIInChI=1S/C10H16ClNSi/c1-9(2)12-13(3,11)10-7-5-4-6-8-10/h4-9,12H,1-3H3
InChIKeyHITPZAWVBCEXMP-UHFFFAOYSA-N
MW213.78 g/mol
LogP2.20
Rot. Bonds3

About N-(chloro-methyl-phenylsilyl)propan-2-amine

N-(chloro-methyl-phenylsilyl)propan-2-amine (PubChem CID 142550256) has the molecular formula C10H16ClNSi and a molecular weight of 213.78 g/mol. Its IUPAC name is N-(chloro-methyl-phenylsilyl)propan-2-amine.

Molecular Properties

Compound NameN-(chloro-methyl-phenylsilyl)propan-2-amine
PubChem CID142550256
Molecular FormulaC10H16ClNSi
Molecular Weight213.78 g/mol
Exact Mass213.07
IUPAC NameN-(chloro-methyl-phenylsilyl)propan-2-amine
SMILESCC(C)N[Si](C)(Cl)c1ccccc1
InChIInChI=1S/C10H16ClNSi/c1-9(2)12-13(3,11)10-7-5-4-6-8-10/h4-9,12H,1-3H3
InChIKeyHITPZAWVBCEXMP-UHFFFAOYSA-N
XLogP2.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.78
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(chloro-methyl-phenylsilyl)propan-2-amine?
The IUPAC name of N-(chloro-methyl-phenylsilyl)propan-2-amine (CID 142550256) is N-(chloro-methyl-phenylsilyl)propan-2-amine.
What is the SMILES notation for N-(chloro-methyl-phenylsilyl)propan-2-amine?
The canonical SMILES for N-(chloro-methyl-phenylsilyl)propan-2-amine is CC(C)N[Si](C)(Cl)c1ccccc1.
What is the InChIKey of N-(chloro-methyl-phenylsilyl)propan-2-amine?
The InChIKey is HITPZAWVBCEXMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16ClNSi/c1-9(2)12-13(3,11)10-7-5-4-6-8-10/h4-9,12H,1-3H3.
What are the key properties of N-(chloro-methyl-phenylsilyl)propan-2-amine?
N-(chloro-methyl-phenylsilyl)propan-2-amine has a molecular weight of 213.78 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(chloro-methyl-phenylsilyl)propan-2-amine is sourced from PubChem (CID 142550256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).