2,2-dimethyl-N'-propyl-N'-[(4-trimethylsilylphenyl)methyl]propane-1,3-diamine

C18H34N2Si — CID 103438203

IUPAC2,2-dimethyl-N'-propyl-N'-[(4-trimethylsilylphenyl)methyl]propane-1,3-diamine
SMILESCCCN(Cc1ccc([Si](C)(C)C)cc1)CC(C)(C)CN
InChIInChI=1S/C18H34N2Si/c1-7-12-20(15-18(2,3)14-19)13-16-8-10-17(11-9-16)21(4,5)6/h8-11H,7,12-15,19H2,1-6H3
InChIKeyBFPZGIFQCNUMSB-UHFFFAOYSA-N
MW306.57 g/mol
LogP3.43
Rot. Bonds8

About 2,2-dimethyl-N'-propyl-N'-[(4-trimethylsilylphenyl)methyl]propane-1,3-diamine

2,2-dimethyl-N'-propyl-N'-[(4-trimethylsilylphenyl)methyl]propane-1,3-diamine (PubChem CID 103438203) has the molecular formula C18H34N2Si and a molecular weight of 306.57 g/mol. Its IUPAC name is 2,2-dimethyl-N'-propyl-N'-[(4-trimethylsilylphenyl)methyl]propane-1,3-diamine.

Molecular Properties

Compound Name2,2-dimethyl-N'-propyl-N'-[(4-trimethylsilylphenyl)methyl]propane-1,3-diamine
PubChem CID103438203
Molecular FormulaC18H34N2Si
Molecular Weight306.57 g/mol
Exact Mass306.25
IUPAC Name2,2-dimethyl-N'-propyl-N'-[(4-trimethylsilylphenyl)methyl]propane-1,3-diamine
SMILESCCCN(Cc1ccc([Si](C)(C)C)cc1)CC(C)(C)CN
InChIInChI=1S/C18H34N2Si/c1-7-12-20(15-18(2,3)14-19)13-16-8-10-17(11-9-16)21(4,5)6/h8-11H,7,12-15,19H2,1-6H3
InChIKeyBFPZGIFQCNUMSB-UHFFFAOYSA-N
XLogP3.43
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.57
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2,2-dimethyl-N'-propyl-N'-[(4-trimethylsilylphenyl)methyl]propane-1,3-diamine 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

4-[[(3-amino-2,2-dimethylpropyl)-propylamino]methyl]benzamide
CID 79662080
N'-[(3,5-dichlorophenyl)methyl]-2,2-dimethyl-N'-propylpropane-1,3-diamine
CID 79667468
N'-[(3-fluorophenyl)methyl]-2,2-dimethyl-N'-propylpropane-1,3-diamine
CID 79667717
N-(cyclopropylmethyl)-N-[(4-trimethylsilylphenyl)methyl]propan-1-amine
CID 103438328
2,2-dimethyl-N'-propyl-N'-(pyridin-2-ylmethyl)propane-1,3-diamine
CID 79668381
N'-[[3-(methoxymethyl)phenyl]methyl]-2,2-dimethyl-N'-propylpropane-1,3-diamine
CID 79668545
methyl 5-[[(3-amino-2,2-dimethylpropyl)-propylamino]methyl]furan-2-carboxylate
CID 79661260
N'-[(2,5-dimethylphenyl)methyl]-2,2-dimethyl-N'-propylpropane-1,3-diamine
CID 79668044
N'-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methyl]-2,2-dimethyl-N'-propylpropane-1,3-diamine
CID 79662014
2,2-dimethyl-N'-propyl-N'-(2-thiophen-2-ylethyl)propane-1,3-diamine
CID 79661594
2,2-dimethyl-N'-propyl-N'-(1,3-thiazol-4-ylmethyl)propane-1,3-diamine
CID 79661265
N'-[(5-chloro-1,3,4-thiadiazol-2-yl)methyl]-2,2-dimethyl-N'-propylpropane-1,3-diamine
CID 80606650

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N'-propyl-N'-[(4-trimethylsilylphenyl)methyl]propane-1,3-diamine?
The IUPAC name of 2,2-dimethyl-N'-propyl-N'-[(4-trimethylsilylphenyl)methyl]propane-1,3-diamine (CID 103438203) is 2,2-dimethyl-N'-propyl-N'-[(4-trimethylsilylphenyl)methyl]propane-1,3-diamine.
What is the SMILES notation for 2,2-dimethyl-N'-propyl-N'-[(4-trimethylsilylphenyl)methyl]propane-1,3-diamine?
The canonical SMILES for 2,2-dimethyl-N'-propyl-N'-[(4-trimethylsilylphenyl)methyl]propane-1,3-diamine is CCCN(Cc1ccc([Si](C)(C)C)cc1)CC(C)(C)CN.
What is the InChIKey of 2,2-dimethyl-N'-propyl-N'-[(4-trimethylsilylphenyl)methyl]propane-1,3-diamine?
The InChIKey is BFPZGIFQCNUMSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2Si/c1-7-12-20(15-18(2,3)14-19)13-16-8-10-17(11-9-16)21(4,5)6/h8-11H,7,12-15,19H2,1-6H3.
What are the key properties of 2,2-dimethyl-N'-propyl-N'-[(4-trimethylsilylphenyl)methyl]propane-1,3-diamine?
2,2-dimethyl-N'-propyl-N'-[(4-trimethylsilylphenyl)methyl]propane-1,3-diamine has a molecular weight of 306.57 g/mol, XLogP of 3.43, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N'-propyl-N'-[(4-trimethylsilylphenyl)methyl]propane-1,3-diamine is sourced from PubChem (CID 103438203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).