CID 142801731

C18H30N2O2Si- — CID 142801731

IUPAC—
SMILESCC(C)(C)[Si-](C)(C)OCCCN1C(=O)C(N)Cc2ccccc21
InChIInChI=1S/C18H30N2O2Si/c1-18(2,3)23(4,5)22-12-8-11-20-16-10-7-6-9-14(16)13-15(19)17(20)21/h6-7,9-10,15H,8,11-13,19H2,1-5H3/q-1
InChIKeyCFTMWPZPSZQHIP-UHFFFAOYSA-N
MW334.54 g/mol
LogP3.31
Rot. Bonds5

About CID 142801731

CID 142801731 (PubChem CID 142801731) has the molecular formula C18H30N2O2Si- and a molecular weight of 334.54 g/mol.

Molecular Properties

Compound NameCID 142801731
PubChem CID142801731
Molecular FormulaC18H30N2O2Si-
Molecular Weight334.54 g/mol
Exact Mass334.21
IUPAC Name—
SMILESCC(C)(C)[Si-](C)(C)OCCCN1C(=O)C(N)Cc2ccccc21
InChIInChI=1S/C18H30N2O2Si/c1-18(2,3)23(4,5)22-12-8-11-20-16-10-7-6-9-14(16)13-15(19)17(20)21/h6-7,9-10,15H,8,11-13,19H2,1-5H3/q-1
InChIKeyCFTMWPZPSZQHIP-UHFFFAOYSA-N
XLogP3.31
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.54
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 142801731?
The IUPAC name of CID 142801731 (CID 142801731) is not available.
What is the SMILES notation for CID 142801731?
The canonical SMILES for CID 142801731 is CC(C)(C)[Si-](C)(C)OCCCN1C(=O)C(N)Cc2ccccc21.
What is the InChIKey of CID 142801731?
The InChIKey is CFTMWPZPSZQHIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O2Si/c1-18(2,3)23(4,5)22-12-8-11-20-16-10-7-6-9-14(16)13-15(19)17(20)21/h6-7,9-10,15H,8,11-13,19H2,1-5H3/q-1.
What are the key properties of CID 142801731?
CID 142801731 has a molecular weight of 334.54 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 142801731 is sourced from PubChem (CID 142801731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).