1-methyl-2,3-dihydro-1H-indene;N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-2,3-dihydro-1H-inden-2-amine;molecular hydrogen

C35H39N7 — CID 153349881

IUPAC1-methyl-2,3-dihydro-1H-indene;N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-2,3-dihydro-1H-inden-2-amine;molecular hydrogen
SMILESCC1CCc2ccccc21.Cc1cccc(-c2[nH]c(CNC3Cc4ccccc4C3)nc2-c2ccc3ncnn3c2)n1.[H][H].[H][H]
InChIInChI=1S/C25H23N7.C10H12.2H2/c1-16-5-4-8-21(29-16)25-24(19-9-10-23-27-15-28-32(23)14-19)30-22(31-25)13-26-20-11-17-6-2-3-7-18(17)12-20;1-8-6-7-9-4-2-3-5-10(8)9;;/h2-10,14-15,20,26H,11-13H2,1H3,(H,30,31);2-5,8H,6-7H2,1H3;2*1H
InChIKeyUTXUZDBMASGBPA-UHFFFAOYSA-N
MW557.75 g/mol
LogP6.98
Rot. Bonds5

About 1-methyl-2,3-dihydro-1H-indene;N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-2,3-dihydro-1H-inden-2-amine;molecular hydrogen

1-methyl-2,3-dihydro-1H-indene;N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-2,3-dihydro-1H-inden-2-amine;molecular hydrogen (PubChem CID 153349881) has the molecular formula C35H39N7 and a molecular weight of 557.75 g/mol. Its IUPAC name is 1-methyl-2,3-dihydro-1H-indene;N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-2,3-dihydro-1H-inden-2-amine;molecular hydrogen.

Molecular Properties

Compound Name1-methyl-2,3-dihydro-1H-indene;N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-2,3-dihydro-1H-inden-2-amine;molecular hydrogen
PubChem CID153349881
Molecular FormulaC35H39N7
Molecular Weight557.75 g/mol
Exact Mass557.33
IUPAC Name1-methyl-2,3-dihydro-1H-indene;N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-2,3-dihydro-1H-inden-2-amine;molecular hydrogen
SMILESCC1CCc2ccccc21.Cc1cccc(-c2[nH]c(CNC3Cc4ccccc4C3)nc2-c2ccc3ncnn3c2)n1.[H][H].[H][H]
InChIInChI=1S/C25H23N7.C10H12.2H2/c1-16-5-4-8-21(29-16)25-24(19-9-10-23-27-15-28-32(23)14-19)30-22(31-25)13-26-20-11-17-6-2-3-7-18(17)12-20;1-8-6-7-9-4-2-3-5-10(8)9;;/h2-10,14-15,20,26H,11-13H2,1H3,(H,30,31);2-5,8H,6-7H2,1H3;2*1H
InChIKeyUTXUZDBMASGBPA-UHFFFAOYSA-N
XLogP6.98
TPSA83.79 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500557.75
LogP ≤ 56.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-methyl-2,3-dihydro-1H-indene;N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-2,3-dihydro-1H-inden-2-amine;molecular hydrogen with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2,3-dihydro-1H-indene;N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-2,3-dihydro-1H-inden-2-amine;molecular hydrogen?
The IUPAC name of 1-methyl-2,3-dihydro-1H-indene;N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-2,3-dihydro-1H-inden-2-amine;molecular hydrogen (CID 153349881) is 1-methyl-2,3-dihydro-1H-indene;N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-2,3-dihydro-1H-inden-2-amine;molecular hydrogen.
What is the SMILES notation for 1-methyl-2,3-dihydro-1H-indene;N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-2,3-dihydro-1H-inden-2-amine;molecular hydrogen?
The canonical SMILES for 1-methyl-2,3-dihydro-1H-indene;N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-2,3-dihydro-1H-inden-2-amine;molecular hydrogen is CC1CCc2ccccc21.Cc1cccc(-c2[nH]c(CNC3Cc4ccccc4C3)nc2-c2ccc3ncnn3c2)n1.[H][H].[H][H].
What is the InChIKey of 1-methyl-2,3-dihydro-1H-indene;N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-2,3-dihydro-1H-inden-2-amine;molecular hydrogen?
The InChIKey is UTXUZDBMASGBPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N7.C10H12.2H2/c1-16-5-4-8-21(29-16)25-24(19-9-10-23-27-15-28-32(23)14-19)30-22(31-25)13-26-20-11-17-6-2-3-7-18(17)12-20;1-8-6-7-9-4-2-3-5-10(8)9;;/h2-10,14-15,20,26H,11-13H2,1H3,(H,30,31);2-5,8H,6-7H2,1H3;2*1H.
What are the key properties of 1-methyl-2,3-dihydro-1H-indene;N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-2,3-dihydro-1H-inden-2-amine;molecular hydrogen?
1-methyl-2,3-dihydro-1H-indene;N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-2,3-dihydro-1H-inden-2-amine;molecular hydrogen has a molecular weight of 557.75 g/mol, XLogP of 6.98, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2,3-dihydro-1H-indene;N-[[5-(6-methyl-2-pyridinyl)-4-([1,2,4]triazolo[1,5-a]pyridin-6-yl)-1H-imidazol-2-yl]methyl]-2,3-dihydro-1H-inden-2-amine;molecular hydrogen is sourced from PubChem (CID 153349881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).