N-[propan-2-yl-bis(propylamino)silyl]propan-1-amine

C12H31N3Si — CID 87081950

IUPACN-[propan-2-yl-bis(propylamino)silyl]propan-1-amine
SMILESCCCN[Si](NCCC)(NCCC)C(C)C
InChIInChI=1S/C12H31N3Si/c1-6-9-13-16(12(4)5,14-10-7-2)15-11-8-3/h12-15H,6-11H2,1-5H3
InChIKeyMRZXOTQKLLBRLH-UHFFFAOYSA-N
MW245.49 g/mol
LogP2.33
Rot. Bonds10

About N-[propan-2-yl-bis(propylamino)silyl]propan-1-amine

N-[propan-2-yl-bis(propylamino)silyl]propan-1-amine (PubChem CID 87081950) has the molecular formula C12H31N3Si and a molecular weight of 245.49 g/mol. Its IUPAC name is N-[propan-2-yl-bis(propylamino)silyl]propan-1-amine.

Molecular Properties

Compound NameN-[propan-2-yl-bis(propylamino)silyl]propan-1-amine
PubChem CID87081950
Molecular FormulaC12H31N3Si
Molecular Weight245.49 g/mol
Exact Mass245.23
IUPAC NameN-[propan-2-yl-bis(propylamino)silyl]propan-1-amine
SMILESCCCN[Si](NCCC)(NCCC)C(C)C
InChIInChI=1S/C12H31N3Si/c1-6-9-13-16(12(4)5,14-10-7-2)15-11-8-3/h12-15H,6-11H2,1-5H3
InChIKeyMRZXOTQKLLBRLH-UHFFFAOYSA-N
XLogP2.33
TPSA36.09 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.49
LogP ≤ 52.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[propan-2-yl-bis(propylamino)silyl]propan-1-amine?
The IUPAC name of N-[propan-2-yl-bis(propylamino)silyl]propan-1-amine (CID 87081950) is N-[propan-2-yl-bis(propylamino)silyl]propan-1-amine.
What is the SMILES notation for N-[propan-2-yl-bis(propylamino)silyl]propan-1-amine?
The canonical SMILES for N-[propan-2-yl-bis(propylamino)silyl]propan-1-amine is CCCN[Si](NCCC)(NCCC)C(C)C.
What is the InChIKey of N-[propan-2-yl-bis(propylamino)silyl]propan-1-amine?
The InChIKey is MRZXOTQKLLBRLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H31N3Si/c1-6-9-13-16(12(4)5,14-10-7-2)15-11-8-3/h12-15H,6-11H2,1-5H3.
What are the key properties of N-[propan-2-yl-bis(propylamino)silyl]propan-1-amine?
N-[propan-2-yl-bis(propylamino)silyl]propan-1-amine has a molecular weight of 245.49 g/mol, XLogP of 2.33, 10 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[propan-2-yl-bis(propylamino)silyl]propan-1-amine is sourced from PubChem (CID 87081950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).