1-(2-chlorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]methanamine

C24H22ClN7 — CID 159784208

IUPAC1-(2-chlorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]methanamine
SMILESCc1cccc(-c2[nH]c(CN(C)Cc3ccccc3Cl)nc2-c2ccc3ncnn3c2)n1
InChIInChI=1S/C24H22ClN7/c1-16-6-5-9-20(28-16)24-23(18-10-11-22-26-15-27-32(22)13-18)29-21(30-24)14-31(2)12-17-7-3-4-8-19(17)25/h3-11,13,15H,12,14H2,1-2H3,(H,29,30)
InChIKeyNHTCGAVJQYADGJ-UHFFFAOYSA-N
MW443.94 g/mol
LogP4.78
Rot. Bonds6

About 1-(2-chlorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]methanamine

1-(2-chlorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]methanamine (PubChem CID 159784208) has the molecular formula C24H22ClN7 and a molecular weight of 443.94 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]methanamine.

Molecular Properties

Compound Name1-(2-chlorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]methanamine
PubChem CID159784208
Molecular FormulaC24H22ClN7
Molecular Weight443.94 g/mol
Exact Mass443.16
IUPAC Name1-(2-chlorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]methanamine
SMILESCc1cccc(-c2[nH]c(CN(C)Cc3ccccc3Cl)nc2-c2ccc3ncnn3c2)n1
InChIInChI=1S/C24H22ClN7/c1-16-6-5-9-20(28-16)24-23(18-10-11-22-26-15-27-32(22)13-18)29-21(30-24)14-31(2)12-17-7-3-4-8-19(17)25/h3-11,13,15H,12,14H2,1-2H3,(H,29,30)
InChIKeyNHTCGAVJQYADGJ-UHFFFAOYSA-N
XLogP4.78
TPSA75.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.94
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-(2-chlorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]methanamine with MolForge

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Related Compounds

2-(2-fluorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]ethanamine
CID 162204745
N-iodo-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-1-[2-(trifluoromethyl)phenyl]methanamine
CID 155582181
(1S,2R)-1-[methyl-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]amino]-2,3-dihydro-1H-inden-2-ol
CID 139569290
6-[2-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-5-(6-methyl-2-pyridinyl)-1H-imidazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridine
CID 157418310
4-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]aniline
CID 54766469
2-fluoro-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]aniline
CID 54766013
(1S)-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-1-phenylethanamine
CID 155582412
4-[(dimethylamino)methyl]-3-[methyl-[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]amino]benzonitrile
CID 66633211
carbon dioxide;(1S)-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-1-phenylethanamine
CID 176547584
6-[2-(azetidin-3-yl)-5-(6-methyl-2-pyridinyl)-1H-imidazol-4-yl]-[1,2,4]triazolo[1,5-a]pyridine
CID 139569221
1-[2-(4-fluorocyclohexa-1,3-dien-1-yl)phenyl]-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]methanamine
CID 156725514
N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]octan-3-amine
CID 153349873

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]methanamine?
The IUPAC name of 1-(2-chlorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]methanamine (CID 159784208) is 1-(2-chlorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]methanamine.
What is the SMILES notation for 1-(2-chlorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]methanamine?
The canonical SMILES for 1-(2-chlorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]methanamine is Cc1cccc(-c2[nH]c(CN(C)Cc3ccccc3Cl)nc2-c2ccc3ncnn3c2)n1.
What is the InChIKey of 1-(2-chlorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]methanamine?
The InChIKey is NHTCGAVJQYADGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22ClN7/c1-16-6-5-9-20(28-16)24-23(18-10-11-22-26-15-27-32(22)13-18)29-21(30-24)14-31(2)12-17-7-3-4-8-19(17)25/h3-11,13,15H,12,14H2,1-2H3,(H,29,30).
What are the key properties of 1-(2-chlorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]methanamine?
1-(2-chlorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]methanamine has a molecular weight of 443.94 g/mol, XLogP of 4.78, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-N-methyl-N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]methanamine is sourced from PubChem (CID 159784208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).