[[carboxy(propyl)amino]-dimethylsilyl]-propylcarbamic acid

C10H22N2O4Si — CID 87274858

IUPAC[[carboxy(propyl)amino]-dimethylsilyl]-propylcarbamic acid
SMILESCCCN(C(=O)O)[Si](C)(C)N(CCC)C(=O)O
InChIInChI=1S/C10H22N2O4Si/c1-5-7-11(9(13)14)17(3,4)12(8-6-2)10(15)16/h5-8H2,1-4H3,(H,13,14)(H,15,16)
InChIKeyLOONBZYQAPBCMT-UHFFFAOYSA-N
MW262.38 g/mol
LogP2.47
Rot. Bonds6

About [[carboxy(propyl)amino]-dimethylsilyl]-propylcarbamic acid

[[carboxy(propyl)amino]-dimethylsilyl]-propylcarbamic acid (PubChem CID 87274858) has the molecular formula C10H22N2O4Si and a molecular weight of 262.38 g/mol. Its IUPAC name is [[carboxy(propyl)amino]-dimethylsilyl]-propylcarbamic acid.

Molecular Properties

Compound Name[[carboxy(propyl)amino]-dimethylsilyl]-propylcarbamic acid
PubChem CID87274858
Molecular FormulaC10H22N2O4Si
Molecular Weight262.38 g/mol
Exact Mass262.13
IUPAC Name[[carboxy(propyl)amino]-dimethylsilyl]-propylcarbamic acid
SMILESCCCN(C(=O)O)[Si](C)(C)N(CCC)C(=O)O
InChIInChI=1S/C10H22N2O4Si/c1-5-7-11(9(13)14)17(3,4)12(8-6-2)10(15)16/h5-8H2,1-4H3,(H,13,14)(H,15,16)
InChIKeyLOONBZYQAPBCMT-UHFFFAOYSA-N
XLogP2.47
TPSA81.08 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.38
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [[carboxy(propyl)amino]-dimethylsilyl]-propylcarbamic acid 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

[[carboxy(hexyl)amino]-dimethylsilyl]-hexylcarbamic acid
CID 87274885
ethane;2-[methyl(propyl)amino]acetic acid
CID 153373363
2-[methyl(propyl)amino]acetic acid;hydrochloride
CID 50988218
1-propyl-1-trimethoxysilylurea
CID 87287857
(E)-2-[propyl(triethoxysilyl)amino]but-2-enedioic acid
CID 88513136
acetic acid;azane;N,N-dimethylpropan-1-amine
CID 89442730
N-[bis[acetyl(butyl)amino]-methylsilyl]-N-butylacetamide
CID 87222114
ethyl N-propyl-N-triethoxysilylcarbamate
CID 54468213
(Z)-but-2-enedioic acid;bis(N,N-dipropylpropan-1-amine)
CID 173189051
3-methyl-4-oxo-4-[propyl(triethoxysilyl)amino]butanoic acid
CID 87357004
prop-2-enyl N-propyl-N-tris(trimethylsilyloxy)silylcarbamate
CID 22412624
hexyl(octadecyl)carbamic acid
CID 87702094

Frequently Asked Questions

What is the IUPAC name of [[carboxy(propyl)amino]-dimethylsilyl]-propylcarbamic acid?
The IUPAC name of [[carboxy(propyl)amino]-dimethylsilyl]-propylcarbamic acid (CID 87274858) is [[carboxy(propyl)amino]-dimethylsilyl]-propylcarbamic acid.
What is the SMILES notation for [[carboxy(propyl)amino]-dimethylsilyl]-propylcarbamic acid?
The canonical SMILES for [[carboxy(propyl)amino]-dimethylsilyl]-propylcarbamic acid is CCCN(C(=O)O)[Si](C)(C)N(CCC)C(=O)O.
What is the InChIKey of [[carboxy(propyl)amino]-dimethylsilyl]-propylcarbamic acid?
The InChIKey is LOONBZYQAPBCMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O4Si/c1-5-7-11(9(13)14)17(3,4)12(8-6-2)10(15)16/h5-8H2,1-4H3,(H,13,14)(H,15,16).
What are the key properties of [[carboxy(propyl)amino]-dimethylsilyl]-propylcarbamic acid?
[[carboxy(propyl)amino]-dimethylsilyl]-propylcarbamic acid has a molecular weight of 262.38 g/mol, XLogP of 2.47, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [[carboxy(propyl)amino]-dimethylsilyl]-propylcarbamic acid is sourced from PubChem (CID 87274858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).