CID 176771085

C20H43N2Si — CID 176771085

IUPAC—
SMILESCCC=C[Si](N(CCCC)CCCC)N(CCCC)CCCC
InChIInChI=1S/C20H43N2Si/c1-6-11-16-21(17-12-7-2)23(20-15-10-5)22(18-13-8-3)19-14-9-4/h15,20H,6-14,16-19H2,1-5H3
InChIKeyPPCDBDFLSHNLAR-UHFFFAOYSA-N
MW339.66 g/mol
LogP5.78
Rot. Bonds16

About CID 176771085

CID 176771085 (PubChem CID 176771085) has the molecular formula C20H43N2Si and a molecular weight of 339.66 g/mol.

Molecular Properties

Compound NameCID 176771085
PubChem CID176771085
Molecular FormulaC20H43N2Si
Molecular Weight339.66 g/mol
Exact Mass339.32
IUPAC Name—
SMILESCCC=C[Si](N(CCCC)CCCC)N(CCCC)CCCC
InChIInChI=1S/C20H43N2Si/c1-6-11-16-21(17-12-7-2)23(20-15-10-5)22(18-13-8-3)19-14-9-4/h15,20H,6-14,16-19H2,1-5H3
InChIKeyPPCDBDFLSHNLAR-UHFFFAOYSA-N
XLogP5.78
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds16
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500339.66
LogP ≤ 55.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N,N-bis(but-1-enyl)butan-1-amine
CID 73433209
N,N,N',N'-tetrabutylbuta-1,3-diene-1,4-diamine
CID 154124490
N,N-dibutylpent-2-enamide
CID 154390041
N-butyl-N-(2-ethoxyethyl)hydroxylamine
CID 88829562
(5E)-octa-3,5-diene
CID 173104147
Bis(dibutyldithiocarbamato-S,S')copper
CID 156614044
N-(3-butoxypropyl)-N-butylbutan-1-amine
CID 152720768
pentadeca-3,5,7,9-tetraene
CID 151958393
[(E)-but-1-enyl]-tributylazanium
CID 176891437
1-[(E)-but-1-enoxy]butane
CID 5364928
(E)-non-3-ene
CID 5364445
hexane;(Z)-pent-2-ene;tetrahydrate
CID 176555754

Frequently Asked Questions

What is the IUPAC name of CID 176771085?
The IUPAC name of CID 176771085 (CID 176771085) is not available.
What is the SMILES notation for CID 176771085?
The canonical SMILES for CID 176771085 is CCC=C[Si](N(CCCC)CCCC)N(CCCC)CCCC.
What is the InChIKey of CID 176771085?
The InChIKey is PPCDBDFLSHNLAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H43N2Si/c1-6-11-16-21(17-12-7-2)23(20-15-10-5)22(18-13-8-3)19-14-9-4/h15,20H,6-14,16-19H2,1-5H3.
What are the key properties of CID 176771085?
CID 176771085 has a molecular weight of 339.66 g/mol, XLogP of 5.78, 16 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 176771085 is sourced from PubChem (CID 176771085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).