4-(cyclopenten-1-yl)-2-(5-piperidin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;4-(2,3-dihydrothiophen-4-yl)-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;ethane;2-[5-(5-methyl-3-pyridinyl)-1H-indazol-3-yl]-4-thiophen-3-yl-1H-imidazo[4,5-c]pyridine

C72H68N18S2 — CID 145034379

IUPAC4-(cyclopenten-1-yl)-2-(5-piperidin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;4-(2,3-dihydrothiophen-4-yl)-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;ethane;2-[5-(5-methyl-3-pyridinyl)-1H-indazol-3-yl]-4-thiophen-3-yl-1H-imidazo[4,5-c]pyridine
SMILESC1=C(c2nccc3[nH]c(-c4n[nH]c5ccc(-c6ccncc6)cc45)nc23)CCS1.C1=C(c2nccc3[nH]c(-c4n[nH]c5ccc(C6CCNCC6)cc45)nc23)CCC1.CC.CC.Cc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6ccsc6)nccc5[nH]4)c3c2)c1
InChIInChI=1S/C23H16N6S.C23H24N6.C22H16N6S.2C2H6/c1-13-8-16(11-24-10-13)14-2-3-18-17(9-14)21(29-28-18)23-26-19-4-6-25-20(22(19)27-23)15-5-7-30-12-15;1-2-4-15(3-1)20-22-19(9-12-25-20)26-23(27-22)21-17-13-16(5-6-18(17)28-29-21)14-7-10-24-11-8-14;1-2-17-16(11-14(1)13-3-7-23-8-4-13)20(28-27-17)22-25-18-5-9-24-19(21(18)26-22)15-6-10-29-12-15;2*1-2/h2-12H,1H3,(H,26,27)(H,28,29);3,5-6,9,12-14,24H,1-2,4,7-8,10-11H2,(H,26,27)(H,28,29);1-5,7-9,11-12H,6,10H2,(H,25,26)(H,27,28);2*1-2H3
InChIKeyQUDPSFNKWKCKMC-UHFFFAOYSA-N
MW1249.60 g/mol
LogP17.23
Rot. Bonds9

About 4-(cyclopenten-1-yl)-2-(5-piperidin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;4-(2,3-dihydrothiophen-4-yl)-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;ethane;2-[5-(5-methyl-3-pyridinyl)-1H-indazol-3-yl]-4-thiophen-3-yl-1H-imidazo[4,5-c]pyridine

4-(cyclopenten-1-yl)-2-(5-piperidin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;4-(2,3-dihydrothiophen-4-yl)-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;ethane;2-[5-(5-methyl-3-pyridinyl)-1H-indazol-3-yl]-4-thiophen-3-yl-1H-imidazo[4,5-c]pyridine (PubChem CID 145034379) has the molecular formula C72H68N18S2 and a molecular weight of 1249.60 g/mol. Its IUPAC name is 4-(cyclopenten-1-yl)-2-(5-piperidin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;4-(2,3-dihydrothiophen-4-yl)-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;ethane;2-[5-(5-methyl-3-pyridinyl)-1H-indazol-3-yl]-4-thiophen-3-yl-1H-imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name4-(cyclopenten-1-yl)-2-(5-piperidin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;4-(2,3-dihydrothiophen-4-yl)-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;ethane;2-[5-(5-methyl-3-pyridinyl)-1H-indazol-3-yl]-4-thiophen-3-yl-1H-imidazo[4,5-c]pyridine
PubChem CID145034379
Molecular FormulaC72H68N18S2
Molecular Weight1249.60 g/mol
Exact Mass1248.53
IUPAC Name4-(cyclopenten-1-yl)-2-(5-piperidin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;4-(2,3-dihydrothiophen-4-yl)-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;ethane;2-[5-(5-methyl-3-pyridinyl)-1H-indazol-3-yl]-4-thiophen-3-yl-1H-imidazo[4,5-c]pyridine
SMILESC1=C(c2nccc3[nH]c(-c4n[nH]c5ccc(-c6ccncc6)cc45)nc23)CCS1.C1=C(c2nccc3[nH]c(-c4n[nH]c5ccc(C6CCNCC6)cc45)nc23)CCC1.CC.CC.Cc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6ccsc6)nccc5[nH]4)c3c2)c1
InChIInChI=1S/C23H16N6S.C23H24N6.C22H16N6S.2C2H6/c1-13-8-16(11-24-10-13)14-2-3-18-17(9-14)21(29-28-18)23-26-19-4-6-25-20(22(19)27-23)15-5-7-30-12-15;1-2-4-15(3-1)20-22-19(9-12-25-20)26-23(27-22)21-17-13-16(5-6-18(17)28-29-21)14-7-10-24-11-8-14;1-2-17-16(11-14(1)13-3-7-23-8-4-13)20(28-27-17)22-25-18-5-9-24-19(21(18)26-22)15-6-10-29-12-15;2*1-2/h2-12H,1H3,(H,26,27)(H,28,29);3,5-6,9,12-14,24H,1-2,4,7-8,10-11H2,(H,26,27)(H,28,29);1-5,7-9,11-12H,6,10H2,(H,25,26)(H,27,28);2*1-2H3
InChIKeyQUDPSFNKWKCKMC-UHFFFAOYSA-N
XLogP17.23
TPSA248.56 Ų
H-Bond Donors7
H-Bond Acceptors14
Rotatable Bonds9
Heavy Atoms92
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001249.60
LogP ≤ 517.23
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1014

Analyze 4-(cyclopenten-1-yl)-2-(5-piperidin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;4-(2,3-dihydrothiophen-4-yl)-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;ethane;2-[5-(5-methyl-3-pyridinyl)-1H-indazol-3-yl]-4-thiophen-3-yl-1H-imidazo[4,5-c]pyridine with MolForge

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Related Compounds

7-(7-(benzo[b]thiophen-2-yl)-1H-indazol-5-yl)-5H-pyrrolo[3,2-d]pyrimidin-2-amine
CID 46224696
7-(7-(benzo[b]thiophen-2-yl)-1H-indazol-5-yl)-5-(2-(piperidin-4-yl)ethyl)-5H-pyrrolo[3,2-d]pyrimidin-2-amine
CID 46224698
N,N-dimethyl-1-[5-[3-(7-thiophen-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]methanamine
CID 136214328
3-methyl-N-[5-[3-(7-thiophen-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1H-indazol-5-yl]-3-pyridinyl]butanamide
CID 136643054
N-[[5-[3-(4-thiophen-3-yl-1H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-3-pyridinyl]methyl]ethanamine
CID 137055196
5-[3-[4-(5-methylthiophen-2-yl)-1H-imidazo[4,5-c]pyridin-2-yl]-1H-pyrazolo[4,3-b]pyridin-5-yl]pyridin-3-amine
CID 137088569
N,N-dimethyl-5-[3-(7-thiophen-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]pyridin-3-amine
CID 136495719
N,N-dimethyl-1-[5-[3-(7-thiophen-3-yl-3H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]methanamine
CID 136213907
1-cyclopentyl-N-[[5-[3-(7-thiophen-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]methyl]methanamine
CID 136214330
N-[5-[3-(7-thiophen-3-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1H-indazol-5-yl]-3-pyridinyl]propanamide
CID 136273256
1-cyclopentyl-N-[[5-[3-(7-thiophen-3-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1H-indazol-5-yl]-3-pyridinyl]methyl]methanamine
CID 136643031
2-[5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]pyridin-3-yl]-1H-indazol-3-yl]-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine
CID 136643073

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopenten-1-yl)-2-(5-piperidin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;4-(2,3-dihydrothiophen-4-yl)-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;ethane;2-[5-(5-methyl-3-pyridinyl)-1H-indazol-3-yl]-4-thiophen-3-yl-1H-imidazo[4,5-c]pyridine?
The IUPAC name of 4-(cyclopenten-1-yl)-2-(5-piperidin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;4-(2,3-dihydrothiophen-4-yl)-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;ethane;2-[5-(5-methyl-3-pyridinyl)-1H-indazol-3-yl]-4-thiophen-3-yl-1H-imidazo[4,5-c]pyridine (CID 145034379) is 4-(cyclopenten-1-yl)-2-(5-piperidin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;4-(2,3-dihydrothiophen-4-yl)-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;ethane;2-[5-(5-methyl-3-pyridinyl)-1H-indazol-3-yl]-4-thiophen-3-yl-1H-imidazo[4,5-c]pyridine.
What is the SMILES notation for 4-(cyclopenten-1-yl)-2-(5-piperidin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;4-(2,3-dihydrothiophen-4-yl)-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;ethane;2-[5-(5-methyl-3-pyridinyl)-1H-indazol-3-yl]-4-thiophen-3-yl-1H-imidazo[4,5-c]pyridine?
The canonical SMILES for 4-(cyclopenten-1-yl)-2-(5-piperidin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;4-(2,3-dihydrothiophen-4-yl)-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;ethane;2-[5-(5-methyl-3-pyridinyl)-1H-indazol-3-yl]-4-thiophen-3-yl-1H-imidazo[4,5-c]pyridine is C1=C(c2nccc3[nH]c(-c4n[nH]c5ccc(-c6ccncc6)cc45)nc23)CCS1.C1=C(c2nccc3[nH]c(-c4n[nH]c5ccc(C6CCNCC6)cc45)nc23)CCC1.CC.CC.Cc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6ccsc6)nccc5[nH]4)c3c2)c1.
What is the InChIKey of 4-(cyclopenten-1-yl)-2-(5-piperidin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;4-(2,3-dihydrothiophen-4-yl)-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;ethane;2-[5-(5-methyl-3-pyridinyl)-1H-indazol-3-yl]-4-thiophen-3-yl-1H-imidazo[4,5-c]pyridine?
The InChIKey is QUDPSFNKWKCKMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N6S.C23H24N6.C22H16N6S.2C2H6/c1-13-8-16(11-24-10-13)14-2-3-18-17(9-14)21(29-28-18)23-26-19-4-6-25-20(22(19)27-23)15-5-7-30-12-15;1-2-4-15(3-1)20-22-19(9-12-25-20)26-23(27-22)21-17-13-16(5-6-18(17)28-29-21)14-7-10-24-11-8-14;1-2-17-16(11-14(1)13-3-7-23-8-4-13)20(28-27-17)22-25-18-5-9-24-19(21(18)26-22)15-6-10-29-12-15;2*1-2/h2-12H,1H3,(H,26,27)(H,28,29);3,5-6,9,12-14,24H,1-2,4,7-8,10-11H2,(H,26,27)(H,28,29);1-5,7-9,11-12H,6,10H2,(H,25,26)(H,27,28);2*1-2H3.
What are the key properties of 4-(cyclopenten-1-yl)-2-(5-piperidin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;4-(2,3-dihydrothiophen-4-yl)-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;ethane;2-[5-(5-methyl-3-pyridinyl)-1H-indazol-3-yl]-4-thiophen-3-yl-1H-imidazo[4,5-c]pyridine?
4-(cyclopenten-1-yl)-2-(5-piperidin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;4-(2,3-dihydrothiophen-4-yl)-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;ethane;2-[5-(5-methyl-3-pyridinyl)-1H-indazol-3-yl]-4-thiophen-3-yl-1H-imidazo[4,5-c]pyridine has a molecular weight of 1249.60 g/mol, XLogP of 17.23, 9 rotatable bonds, 7 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopenten-1-yl)-2-(5-piperidin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;4-(2,3-dihydrothiophen-4-yl)-2-(5-pyridin-4-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine;ethane;2-[5-(5-methyl-3-pyridinyl)-1H-indazol-3-yl]-4-thiophen-3-yl-1H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 145034379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).