N-[[butyl(propyl)amino]-prop-1-enylsilyl]-N-propylbutan-1-amine

C17H38N2Si — CID 157351468

IUPACN-[[butyl(propyl)amino]-prop-1-enylsilyl]-N-propylbutan-1-amine
SMILESCC=C[SiH](N(CCC)CCCC)N(CCC)CCCC
InChIInChI=1S/C17H38N2Si/c1-6-11-15-18(13-8-3)20(17-10-5)19(14-9-4)16-12-7-2/h10,17,20H,6-9,11-16H2,1-5H3
InChIKeyBHOWGTFYFBXMOG-UHFFFAOYSA-N
MW298.59 g/mol
LogP4.35
Rot. Bonds13

About N-[[butyl(propyl)amino]-prop-1-enylsilyl]-N-propylbutan-1-amine

N-[[butyl(propyl)amino]-prop-1-enylsilyl]-N-propylbutan-1-amine (PubChem CID 157351468) has the molecular formula C17H38N2Si and a molecular weight of 298.59 g/mol. Its IUPAC name is N-[[butyl(propyl)amino]-prop-1-enylsilyl]-N-propylbutan-1-amine.

Molecular Properties

Compound NameN-[[butyl(propyl)amino]-prop-1-enylsilyl]-N-propylbutan-1-amine
PubChem CID157351468
Molecular FormulaC17H38N2Si
Molecular Weight298.59 g/mol
Exact Mass298.28
IUPAC NameN-[[butyl(propyl)amino]-prop-1-enylsilyl]-N-propylbutan-1-amine
SMILESCC=C[SiH](N(CCC)CCCC)N(CCC)CCCC
InChIInChI=1S/C17H38N2Si/c1-6-11-15-18(13-8-3)20(17-10-5)19(14-9-4)16-12-7-2/h10,17,20H,6-9,11-16H2,1-5H3
InChIKeyBHOWGTFYFBXMOG-UHFFFAOYSA-N
XLogP4.35
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.59
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-[[butyl(propyl)amino]-prop-1-enylsilyl]-N-propylbutan-1-amine?
The IUPAC name of N-[[butyl(propyl)amino]-prop-1-enylsilyl]-N-propylbutan-1-amine (CID 157351468) is N-[[butyl(propyl)amino]-prop-1-enylsilyl]-N-propylbutan-1-amine.
What is the SMILES notation for N-[[butyl(propyl)amino]-prop-1-enylsilyl]-N-propylbutan-1-amine?
The canonical SMILES for N-[[butyl(propyl)amino]-prop-1-enylsilyl]-N-propylbutan-1-amine is CC=C[SiH](N(CCC)CCCC)N(CCC)CCCC.
What is the InChIKey of N-[[butyl(propyl)amino]-prop-1-enylsilyl]-N-propylbutan-1-amine?
The InChIKey is BHOWGTFYFBXMOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H38N2Si/c1-6-11-15-18(13-8-3)20(17-10-5)19(14-9-4)16-12-7-2/h10,17,20H,6-9,11-16H2,1-5H3.
What are the key properties of N-[[butyl(propyl)amino]-prop-1-enylsilyl]-N-propylbutan-1-amine?
N-[[butyl(propyl)amino]-prop-1-enylsilyl]-N-propylbutan-1-amine has a molecular weight of 298.59 g/mol, XLogP of 4.35, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[butyl(propyl)amino]-prop-1-enylsilyl]-N-propylbutan-1-amine is sourced from PubChem (CID 157351468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).