CID 174070100

C24H26N9Si — CID 174070100

IUPAC—
SMILESC[Si]1CN(Cc2ccc3nc(Cn4cc(-c5cncc(-n6cccc6)c5)nn4)cn3c2)CCN1
InChIInChI=1S/C24H26N9Si/c1-34-18-30(9-6-26-34)13-19-4-5-24-27-21(15-32(24)14-19)16-33-17-23(28-29-33)20-10-22(12-25-11-20)31-7-2-3-8-31/h2-5,7-8,10-12,14-15,17,26H,6,9,13,16,18H2,1H3
InChIKeyZDZNBTOEACDJLX-UHFFFAOYSA-N
MW468.62 g/mol
LogP2.39
Rot. Bonds6

About CID 174070100

CID 174070100 (PubChem CID 174070100) has the molecular formula C24H26N9Si and a molecular weight of 468.62 g/mol.

Molecular Properties

Compound NameCID 174070100
PubChem CID174070100
Molecular FormulaC24H26N9Si
Molecular Weight468.62 g/mol
Exact Mass468.21
IUPAC Name—
SMILESC[Si]1CN(Cc2ccc3nc(Cn4cc(-c5cncc(-n6cccc6)c5)nn4)cn3c2)CCN1
InChIInChI=1S/C24H26N9Si/c1-34-18-30(9-6-26-34)13-19-4-5-24-27-21(15-32(24)14-19)16-33-17-23(28-29-33)20-10-22(12-25-11-20)31-7-2-3-8-31/h2-5,7-8,10-12,14-15,17,26H,6,9,13,16,18H2,1H3
InChIKeyZDZNBTOEACDJLX-UHFFFAOYSA-N
XLogP2.39
TPSA81.10 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500468.62
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

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Related Compounds

1-cyclobutyl-N-[[2-[[4-[5-(2,5-dihydropyrrol-1-yl)-3-pyridinyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]methyl]methanamine
CID 171084244
N-[(4-fluoro-1-bicyclo[2.2.2]octanyl)methyl]-1-[2-[[4-(5-pyrrolidin-1-yl-3-pyridinyl)triazol-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]methanamine
CID 176815806
tert-butyl N-[[2-[[4-[5-(2,5-dihydropyrrol-1-yl)-3-pyridinyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]methyl]-N-[(3-fluoro-1-bicyclo[1.1.1]pentanyl)methyl]carbamate
CID 176815719
2-(4-fluoro-1-bicyclo[2.2.2]octanyl)-1-[2-[[4-(5-pyrrolidin-1-yl-3-pyridinyl)triazol-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]ethanamine
CID 177306185
2-[[4-[5-(dimethylamino)-3-pyridinyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridine-6-carbaldehyde
CID 171084299
2-(3-fluoro-1-bicyclo[1.1.1]pentanyl)-1-[2-[[4-[5-(3-methylpyrrolidin-1-yl)-3-pyridinyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]ethanamine
CID 177306190
tert-butyl N-(cyclobutylmethyl)-N-[[2-[[4-[5-(3,3-difluoropyrrolidin-1-yl)-3-pyridinyl]triazol-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]methyl]carbamate
CID 176815710
[2-[[4-(4-chloro-5-pyrrolidin-1-yl-3-pyridinyl)triazol-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]methanol
CID 171084400
tert-butyl N-[[2-[[4-(5-bromo-3-pyridinyl)triazol-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]methyl]-N-(cyclobutylmethyl)carbamate
CID 176815794
3-(1-ethyltriazol-4-yl)-5-(3-methylpyrrol-1-yl)pyridine
CID 176815572
tert-butyl N-(cyclobutylmethyl)-N-[[2-[(4-pyridin-3-yltriazol-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]methyl]carbamate
CID 171084209
[5-[1-(imidazo[1,2-a]pyridin-2-ylmethyl)triazol-4-yl]-2-pyridinyl]methanol
CID 166401701

Frequently Asked Questions

What is the IUPAC name of CID 174070100?
The IUPAC name of CID 174070100 (CID 174070100) is not available.
What is the SMILES notation for CID 174070100?
The canonical SMILES for CID 174070100 is C[Si]1CN(Cc2ccc3nc(Cn4cc(-c5cncc(-n6cccc6)c5)nn4)cn3c2)CCN1.
What is the InChIKey of CID 174070100?
The InChIKey is ZDZNBTOEACDJLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N9Si/c1-34-18-30(9-6-26-34)13-19-4-5-24-27-21(15-32(24)14-19)16-33-17-23(28-29-33)20-10-22(12-25-11-20)31-7-2-3-8-31/h2-5,7-8,10-12,14-15,17,26H,6,9,13,16,18H2,1H3.
What are the key properties of CID 174070100?
CID 174070100 has a molecular weight of 468.62 g/mol, XLogP of 2.39, 6 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174070100 is sourced from PubChem (CID 174070100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).