N-[1-[[3-(benzylamino)-3-oxopropyl]-methylsilyl]-3-methylbutyl]benzamide

C23H32N2O2Si — CID 123371015

IUPACN-[1-[[3-(benzylamino)-3-oxopropyl]-methylsilyl]-3-methylbutyl]benzamide
SMILESCC(C)CC(NC(=O)c1ccccc1)[SiH](C)CCC(=O)NCc1ccccc1
InChIInChI=1S/C23H32N2O2Si/c1-18(2)16-22(25-23(27)20-12-8-5-9-13-20)28(3)15-14-21(26)24-17-19-10-6-4-7-11-19/h4-13,18,22,28H,14-17H2,1-3H3,(H,24,26)(H,25,27)
InChIKeyDUIPZSGXTGLLHK-UHFFFAOYSA-N
MW396.61 g/mol
LogP3.93
Rot. Bonds10

About N-[1-[[3-(benzylamino)-3-oxopropyl]-methylsilyl]-3-methylbutyl]benzamide

N-[1-[[3-(benzylamino)-3-oxopropyl]-methylsilyl]-3-methylbutyl]benzamide (PubChem CID 123371015) has the molecular formula C23H32N2O2Si and a molecular weight of 396.61 g/mol. Its IUPAC name is N-[1-[[3-(benzylamino)-3-oxopropyl]-methylsilyl]-3-methylbutyl]benzamide.

Molecular Properties

Compound NameN-[1-[[3-(benzylamino)-3-oxopropyl]-methylsilyl]-3-methylbutyl]benzamide
PubChem CID123371015
Molecular FormulaC23H32N2O2Si
Molecular Weight396.61 g/mol
Exact Mass396.22
IUPAC NameN-[1-[[3-(benzylamino)-3-oxopropyl]-methylsilyl]-3-methylbutyl]benzamide
SMILESCC(C)CC(NC(=O)c1ccccc1)[SiH](C)CCC(=O)NCc1ccccc1
InChIInChI=1S/C23H32N2O2Si/c1-18(2)16-22(25-23(27)20-12-8-5-9-13-20)28(3)15-14-21(26)24-17-19-10-6-4-7-11-19/h4-13,18,22,28H,14-17H2,1-3H3,(H,24,26)(H,25,27)
InChIKeyDUIPZSGXTGLLHK-UHFFFAOYSA-N
XLogP3.93
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.61
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[1-[[3-(benzylamino)-3-oxopropyl]-methylsilyl]-3-methylbutyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-butan-2-yl-3-[(3-phenylpropanoylamino)methyl]benzamide
CID 47043715
5-(benzylamino)-2-methyl-5-oxopentanoic acid
CID 112515547
N-[1-[4-[2-(benzylamino)-2-oxoethyl]piperazin-1-yl]-1-oxopropan-2-yl]benzamide
CID 55495610
N-[4-[(4-fluorophenyl)methylamino]-4-oxobutan-2-yl]benzamide
CID 51195280
N-benzyl-4-[2-[4-[[[4-(benzylamino)-4-oxobutanoyl]amino]carbamoyl]benzoyl]hydrazinyl]-4-oxobutanamide
CID 3359263
N-benzyl-4,4-difluorobutanamide
CID 132965820
N-[4-[[4-[(dimethylamino)methyl]phenyl]methylamino]-4-oxobutan-2-yl]benzamide
CID 134029595
3-[(3-aminopropanoylamino)methyl]-N-butan-2-ylbenzamide
CID 119287321
N-[1-[5-[2-(benzylamino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]-3-methylbutyl]benzamide
CID 21379226
N-(3-methyl-1-phenylbutyl)benzamide
CID 46770250
(2S)-N-benzyl-2-hydroxy-4-methylpentanamide
CID 10822877
N-[1-(benzylamino)-1-oxo-3-phenylpropan-2-yl]benzamide
CID 17475548

Frequently Asked Questions

What is the IUPAC name of N-[1-[[3-(benzylamino)-3-oxopropyl]-methylsilyl]-3-methylbutyl]benzamide?
The IUPAC name of N-[1-[[3-(benzylamino)-3-oxopropyl]-methylsilyl]-3-methylbutyl]benzamide (CID 123371015) is N-[1-[[3-(benzylamino)-3-oxopropyl]-methylsilyl]-3-methylbutyl]benzamide.
What is the SMILES notation for N-[1-[[3-(benzylamino)-3-oxopropyl]-methylsilyl]-3-methylbutyl]benzamide?
The canonical SMILES for N-[1-[[3-(benzylamino)-3-oxopropyl]-methylsilyl]-3-methylbutyl]benzamide is CC(C)CC(NC(=O)c1ccccc1)[SiH](C)CCC(=O)NCc1ccccc1.
What is the InChIKey of N-[1-[[3-(benzylamino)-3-oxopropyl]-methylsilyl]-3-methylbutyl]benzamide?
The InChIKey is DUIPZSGXTGLLHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N2O2Si/c1-18(2)16-22(25-23(27)20-12-8-5-9-13-20)28(3)15-14-21(26)24-17-19-10-6-4-7-11-19/h4-13,18,22,28H,14-17H2,1-3H3,(H,24,26)(H,25,27).
What are the key properties of N-[1-[[3-(benzylamino)-3-oxopropyl]-methylsilyl]-3-methylbutyl]benzamide?
N-[1-[[3-(benzylamino)-3-oxopropyl]-methylsilyl]-3-methylbutyl]benzamide has a molecular weight of 396.61 g/mol, XLogP of 3.93, 10 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[[3-(benzylamino)-3-oxopropyl]-methylsilyl]-3-methylbutyl]benzamide is sourced from PubChem (CID 123371015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).