CID 22358458

C4H9N2OSi — CID 22358458

IUPAC—
SMILESCCCN([Si])C(N)=O
InChIInChI=1S/C4H9N2OSi/c1-2-3-6(8)4(5)7/h2-3H2,1H3,(H2,5,7)
InChIKeyYLNPQJMOZROWBB-UHFFFAOYSA-N
MW129.22 g/mol
LogP-0.14
Rot. Bonds2

About CID 22358458

CID 22358458 (PubChem CID 22358458) has the molecular formula C4H9N2OSi and a molecular weight of 129.22 g/mol.

Molecular Properties

Compound NameCID 22358458
PubChem CID22358458
Molecular FormulaC4H9N2OSi
Molecular Weight129.22 g/mol
Exact Mass129.05
IUPAC Name—
SMILESCCCN([Si])C(N)=O
InChIInChI=1S/C4H9N2OSi/c1-2-3-6(8)4(5)7/h2-3H2,1H3,(H2,5,7)
InChIKeyYLNPQJMOZROWBB-UHFFFAOYSA-N
XLogP-0.14
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.22
LogP ≤ 5-0.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N,N-dimethylpropan-1-amine;bis(prop-2-enamide)
CID 158610265
[carbamoyl(propyl)amino]methylphosphonic acid
CID 87653708
1-propyl-1-trimethoxysilylurea
CID 87287857
2-(dipropylamino)propanamide
CID 18474126
1-[6-[carbamoyl(octadecyl)amino]hexyl]-1-octadecylurea
CID 87213493
sodium;carbamothioic S-acid;dipropylcarbamothioic S-acid;hydride
CID 173333839
1-butyl-1-dodecylurea
CID 168918855
3-amino-N,N-dipropylbutanamide
CID 60836307
2-[methyl(propyl)amino]butanamide
CID 62900463
1-chloro-1-hexylurea
CID 175264526
3-(dipropylamino)-2-methylprop-2-enamide
CID 123925516
1-butyl-1-(3-hydroxypropyl)urea
CID 87441686

Frequently Asked Questions

What is the IUPAC name of CID 22358458?
The IUPAC name of CID 22358458 (CID 22358458) is not available.
What is the SMILES notation for CID 22358458?
The canonical SMILES for CID 22358458 is CCCN([Si])C(N)=O.
What is the InChIKey of CID 22358458?
The InChIKey is YLNPQJMOZROWBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9N2OSi/c1-2-3-6(8)4(5)7/h2-3H2,1H3,(H2,5,7).
What are the key properties of CID 22358458?
CID 22358458 has a molecular weight of 129.22 g/mol, XLogP of -0.14, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 22358458 is sourced from PubChem (CID 22358458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).