7-(4-methylpiperazin-1-yl)-2-(5-pyridin-3-yl-2H-indazol-3-yl)-2,3-dihydro-1H-imidazo[4,5-c]pyridine

C23H24N8 — CID 90244183

IUPAC7-(4-methylpiperazin-1-yl)-2-(5-pyridin-3-yl-2H-indazol-3-yl)-2,3-dihydro-1H-imidazo[4,5-c]pyridine
SMILESCN1CCN(c2cncc3c2NC(c2[nH]nc4ccc(-c5cccnc5)cc24)N3)CC1
InChIInChI=1S/C23H24N8/c1-30-7-9-31(10-8-30)20-14-25-13-19-22(20)27-23(26-19)21-17-11-15(4-5-18(17)28-29-21)16-3-2-6-24-12-16/h2-6,11-14,23,26-27H,7-10H2,1H3,(H,28,29)
InChIKeyPZVSOCHZEIQZFL-UHFFFAOYSA-N
MW412.50 g/mol
LogP3.31
Rot. Bonds3

About 7-(4-methylpiperazin-1-yl)-2-(5-pyridin-3-yl-2H-indazol-3-yl)-2,3-dihydro-1H-imidazo[4,5-c]pyridine

7-(4-methylpiperazin-1-yl)-2-(5-pyridin-3-yl-2H-indazol-3-yl)-2,3-dihydro-1H-imidazo[4,5-c]pyridine (PubChem CID 90244183) has the molecular formula C23H24N8 and a molecular weight of 412.50 g/mol. Its IUPAC name is 7-(4-methylpiperazin-1-yl)-2-(5-pyridin-3-yl-2H-indazol-3-yl)-2,3-dihydro-1H-imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name7-(4-methylpiperazin-1-yl)-2-(5-pyridin-3-yl-2H-indazol-3-yl)-2,3-dihydro-1H-imidazo[4,5-c]pyridine
PubChem CID90244183
Molecular FormulaC23H24N8
Molecular Weight412.50 g/mol
Exact Mass412.21
IUPAC Name7-(4-methylpiperazin-1-yl)-2-(5-pyridin-3-yl-2H-indazol-3-yl)-2,3-dihydro-1H-imidazo[4,5-c]pyridine
SMILESCN1CCN(c2cncc3c2NC(c2[nH]nc4ccc(-c5cccnc5)cc24)N3)CC1
InChIInChI=1S/C23H24N8/c1-30-7-9-31(10-8-30)20-14-25-13-19-22(20)27-23(26-19)21-17-11-15(4-5-18(17)28-29-21)16-3-2-6-24-12-16/h2-6,11-14,23,26-27H,7-10H2,1H3,(H,28,29)
InChIKeyPZVSOCHZEIQZFL-UHFFFAOYSA-N
XLogP3.31
TPSA85.00 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.50
LogP ≤ 53.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

N-[5-[3-[4-(4-methylpiperazin-1-yl)-2,3-dihydro-1H-benzimidazol-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]cyclobutanecarboxamide
CID 90078651
3-[6-(4-methylsulfonylpiperazin-1-yl)-1,4-dihydropyrimidin-4-yl]-5-pyridin-3-yl-2H-indazole
CID 130372513
3-[4-(4-methylpiperazin-1-yl)-1H-pyrrolo[3,2-c]pyridin-2-yl]-5-pyridin-3-yl-2H-pyrazolo[3,4-b]pyridine
CID 137310785
1-cyclopentyl-N-[[5-[3-(4-pyridin-2-yl-2,3-dihydro-1H-benzimidazol-2-yl)-2H-indazol-5-yl]-3-pyridinyl]methyl]methanamine
CID 90287111
N-[[4-methyl-5-[3-(7-pyrrolidin-1-yl-2,3-dihydro-1H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]methyl]ethanamine
CID 163606251
1-[2-(4-methylpiperazin-1-yl)-5-pyridin-3-ylphenyl]prop-2-en-1-one
CID 91511620
N,N-dimethyl-5-[3-[4-(4-methylpiperazin-1-yl)-1H-indol-2-yl]-1H-indazol-5-yl]pyridin-3-amine
CID 137115280
3-[4-(4-methylpiperazin-1-yl)-1H-pyrrolo[2,3-c]pyridin-2-yl]-5-pyridin-4-yl-1H-indazole
CID 137117082
4-(4-methylpiperazin-1-yl)-6-(1H-pyrazol-4-yl)quinoline
CID 22032346
1-[2-chloro-4-(4-methylpiperazin-1-yl)phenyl]-3-methyl-8-pyridin-3-ylimidazo[4,5-c]quinolin-2-one
CID 11978553
(4-methylpiperazin-1-yl)-(8-pyridin-3-yl-3H-pyrrolo[2,3-c]isoquinolin-1-yl)methanone
CID 168926549
3-[4-(4-methylpiperazin-1-yl)-1H-pyrrolo[2,3-c]pyridin-2-yl]-5-pyrazin-2-yl-2H-pyrazolo[3,4-b]pyridine
CID 137040932

Frequently Asked Questions

What is the IUPAC name of 7-(4-methylpiperazin-1-yl)-2-(5-pyridin-3-yl-2H-indazol-3-yl)-2,3-dihydro-1H-imidazo[4,5-c]pyridine?
The IUPAC name of 7-(4-methylpiperazin-1-yl)-2-(5-pyridin-3-yl-2H-indazol-3-yl)-2,3-dihydro-1H-imidazo[4,5-c]pyridine (CID 90244183) is 7-(4-methylpiperazin-1-yl)-2-(5-pyridin-3-yl-2H-indazol-3-yl)-2,3-dihydro-1H-imidazo[4,5-c]pyridine.
What is the SMILES notation for 7-(4-methylpiperazin-1-yl)-2-(5-pyridin-3-yl-2H-indazol-3-yl)-2,3-dihydro-1H-imidazo[4,5-c]pyridine?
The canonical SMILES for 7-(4-methylpiperazin-1-yl)-2-(5-pyridin-3-yl-2H-indazol-3-yl)-2,3-dihydro-1H-imidazo[4,5-c]pyridine is CN1CCN(c2cncc3c2NC(c2[nH]nc4ccc(-c5cccnc5)cc24)N3)CC1.
What is the InChIKey of 7-(4-methylpiperazin-1-yl)-2-(5-pyridin-3-yl-2H-indazol-3-yl)-2,3-dihydro-1H-imidazo[4,5-c]pyridine?
The InChIKey is PZVSOCHZEIQZFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N8/c1-30-7-9-31(10-8-30)20-14-25-13-19-22(20)27-23(26-19)21-17-11-15(4-5-18(17)28-29-21)16-3-2-6-24-12-16/h2-6,11-14,23,26-27H,7-10H2,1H3,(H,28,29).
What are the key properties of 7-(4-methylpiperazin-1-yl)-2-(5-pyridin-3-yl-2H-indazol-3-yl)-2,3-dihydro-1H-imidazo[4,5-c]pyridine?
7-(4-methylpiperazin-1-yl)-2-(5-pyridin-3-yl-2H-indazol-3-yl)-2,3-dihydro-1H-imidazo[4,5-c]pyridine has a molecular weight of 412.50 g/mol, XLogP of 3.31, 3 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-methylpiperazin-1-yl)-2-(5-pyridin-3-yl-2H-indazol-3-yl)-2,3-dihydro-1H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 90244183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).