methyl N-pyridin-2-yl-N-[4-[tri(propan-2-yl)silyloxymethyl]phenyl]carbamate

C23H34N2O3Si — CID 134100731

IUPACmethyl N-pyridin-2-yl-N-[4-[tri(propan-2-yl)silyloxymethyl]phenyl]carbamate
SMILESCOC(=O)N(c1ccc(CO[Si](C(C)C)(C(C)C)C(C)C)cc1)c1ccccn1
InChIInChI=1S/C23H34N2O3Si/c1-17(2)29(18(3)4,19(5)6)28-16-20-11-13-21(14-12-20)25(23(26)27-7)22-10-8-9-15-24-22/h8-15,17-19H,16H2,1-7H3
InChIKeyNGPIGDOZGBDHMH-UHFFFAOYSA-N
MW414.62 g/mol
LogP6.68
Rot. Bonds8

About methyl N-pyridin-2-yl-N-[4-[tri(propan-2-yl)silyloxymethyl]phenyl]carbamate

methyl N-pyridin-2-yl-N-[4-[tri(propan-2-yl)silyloxymethyl]phenyl]carbamate (PubChem CID 134100731) has the molecular formula C23H34N2O3Si and a molecular weight of 414.62 g/mol. Its IUPAC name is methyl N-pyridin-2-yl-N-[4-[tri(propan-2-yl)silyloxymethyl]phenyl]carbamate.

Molecular Properties

Compound Namemethyl N-pyridin-2-yl-N-[4-[tri(propan-2-yl)silyloxymethyl]phenyl]carbamate
PubChem CID134100731
Molecular FormulaC23H34N2O3Si
Molecular Weight414.62 g/mol
Exact Mass414.23
IUPAC Namemethyl N-pyridin-2-yl-N-[4-[tri(propan-2-yl)silyloxymethyl]phenyl]carbamate
SMILESCOC(=O)N(c1ccc(CO[Si](C(C)C)(C(C)C)C(C)C)cc1)c1ccccn1
InChIInChI=1S/C23H34N2O3Si/c1-17(2)29(18(3)4,19(5)6)28-16-20-11-13-21(14-12-20)25(23(26)27-7)22-10-8-9-15-24-22/h8-15,17-19H,16H2,1-7H3
InChIKeyNGPIGDOZGBDHMH-UHFFFAOYSA-N
XLogP6.68
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.62
LogP ≤ 56.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze methyl N-pyridin-2-yl-N-[4-[tri(propan-2-yl)silyloxymethyl]phenyl]carbamate 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

ethyl N-phenyl-N-pyridin-2-ylcarbamate
CID 2783435
2-[4-[methyl(pyridin-2-yl)amino]phenyl]acetic acid
CID 54597167
2-methoxy-N-methyl-N-pyridin-2-ylpropanamide
CID 115640276
ethyl 3-oxo-3-(N-pyridin-2-ylanilino)propanoate
CID 135020038
N,2-diphenyl-N-pyridin-2-ylacetamide
CID 24832254
N,2-dimethyl-3-(methylamino)-N-pyridin-2-ylpropanamide
CID 79196155
cyclohexylmethyl N-phenyl-N-pyridin-2-ylcarbamate;2-methoxyacetic acid
CID 143865612
[4-[4-(prop-2-enoyloxymethyl)-N-pyridin-2-ylanilino]phenyl]methyl prop-2-enoate
CID 59935337
methyl 2-[[methyl(pyridin-2-yl)amino]methyl]butanoate
CID 115253091
(2S)-N,2,4-trimethyl-N-pyridin-2-ylpent-4-enamide
CID 124618003
benzyl N-(2-bromoethyl)-N-[2-tri(propan-2-yl)silyloxyethyl]carbamate
CID 20740326
N-methyl-N-pyridin-2-ylpyridin-2-amine
CID 14365053

Frequently Asked Questions

What is the IUPAC name of methyl N-pyridin-2-yl-N-[4-[tri(propan-2-yl)silyloxymethyl]phenyl]carbamate?
The IUPAC name of methyl N-pyridin-2-yl-N-[4-[tri(propan-2-yl)silyloxymethyl]phenyl]carbamate (CID 134100731) is methyl N-pyridin-2-yl-N-[4-[tri(propan-2-yl)silyloxymethyl]phenyl]carbamate.
What is the SMILES notation for methyl N-pyridin-2-yl-N-[4-[tri(propan-2-yl)silyloxymethyl]phenyl]carbamate?
The canonical SMILES for methyl N-pyridin-2-yl-N-[4-[tri(propan-2-yl)silyloxymethyl]phenyl]carbamate is COC(=O)N(c1ccc(CO[Si](C(C)C)(C(C)C)C(C)C)cc1)c1ccccn1.
What is the InChIKey of methyl N-pyridin-2-yl-N-[4-[tri(propan-2-yl)silyloxymethyl]phenyl]carbamate?
The InChIKey is NGPIGDOZGBDHMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H34N2O3Si/c1-17(2)29(18(3)4,19(5)6)28-16-20-11-13-21(14-12-20)25(23(26)27-7)22-10-8-9-15-24-22/h8-15,17-19H,16H2,1-7H3.
What are the key properties of methyl N-pyridin-2-yl-N-[4-[tri(propan-2-yl)silyloxymethyl]phenyl]carbamate?
methyl N-pyridin-2-yl-N-[4-[tri(propan-2-yl)silyloxymethyl]phenyl]carbamate has a molecular weight of 414.62 g/mol, XLogP of 6.68, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-pyridin-2-yl-N-[4-[tri(propan-2-yl)silyloxymethyl]phenyl]carbamate is sourced from PubChem (CID 134100731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).