10-[3-[2-(9H-acridin-10-yl)-3-pyridinyl]-2-pyridinyl]-9H-acridine

C36H26N4 — CID 140910342

IUPAC10-[3-[2-(9H-acridin-10-yl)-3-pyridinyl]-2-pyridinyl]-9H-acridine
SMILESc1ccc2c(c1)Cc1ccccc1N2c1ncccc1-c1cccnc1N1c2ccccc2Cc2ccccc21
InChIInChI=1S/C36H26N4/c1-5-17-31-25(11-1)23-26-12-2-6-18-32(26)39(31)35-29(15-9-21-37-35)30-16-10-22-38-36(30)40-33-19-7-3-13-27(33)24-28-14-4-8-20-34(28)40/h1-22H,23-24H2
InChIKeyTWCCMEWQJQQTAS-UHFFFAOYSA-N
MW514.63 g/mol
LogP8.89
Rot. Bonds3

About 10-[3-[2-(9H-acridin-10-yl)-3-pyridinyl]-2-pyridinyl]-9H-acridine

10-[3-[2-(9H-acridin-10-yl)-3-pyridinyl]-2-pyridinyl]-9H-acridine (PubChem CID 140910342) has the molecular formula C36H26N4 and a molecular weight of 514.63 g/mol. Its IUPAC name is 10-[3-[2-(9H-acridin-10-yl)-3-pyridinyl]-2-pyridinyl]-9H-acridine.

Molecular Properties

Compound Name10-[3-[2-(9H-acridin-10-yl)-3-pyridinyl]-2-pyridinyl]-9H-acridine
PubChem CID140910342
Molecular FormulaC36H26N4
Molecular Weight514.63 g/mol
Exact Mass514.22
IUPAC Name10-[3-[2-(9H-acridin-10-yl)-3-pyridinyl]-2-pyridinyl]-9H-acridine
SMILESc1ccc2c(c1)Cc1ccccc1N2c1ncccc1-c1cccnc1N1c2ccccc2Cc2ccccc21
InChIInChI=1S/C36H26N4/c1-5-17-31-25(11-1)23-26-12-2-6-18-32(26)39(31)35-29(15-9-21-37-35)30-16-10-22-38-36(30)40-33-19-7-3-13-27(33)24-28-14-4-8-20-34(28)40/h1-22H,23-24H2
InChIKeyTWCCMEWQJQQTAS-UHFFFAOYSA-N
XLogP8.89
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500514.63
LogP ≤ 58.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 10-[3-[2-(9H-acridin-10-yl)-3-pyridinyl]-2-pyridinyl]-9H-acridine with MolForge

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Related Compounds

25,27-diazanonacyclo[17.15.1.02,17.04,16.07,15.08,13.021,26.027,35.028,33]pentatriaconta-1(35),2(17),4(16),5,7(15),8,10,12,18,21(26),22,24,28,30,32-pentadecaene
CID 167541952
1,26-diazaheptacyclo[14.11.1.02,14.05,13.07,12.020,28.022,27]octacosa-2(14),3,5(13),7,9,11,16,18,20(28),22(27),23,25-dodecaene
CID 167534650
7,9,11-triazaheptacyclo[15.10.1.03,8.09,28.010,15.018,26.019,24]octacosa-1(28),3(8),4,6,10(15),11,13,17,19,21,23,26-dodecaene
CID 167544398
1,26-diazaheptacyclo[14.11.1.02,14.04,12.06,11.020,28.022,27]octacosa-2,4(12),6,8,10,13,16,18,20(28),22(27),23,25-dodecaene
CID 167548940
1,33-diazanonacyclo[21.11.1.02,21.04,19.06,18.08,16.09,14.027,35.029,34]pentatriaconta-2,4(19),6(18),7,9,11,13,16,20,23,25,27(35),29(34),30,32-pentadecaene
CID 167622182
22,27-diazanonacyclo[17.15.1.02,17.04,16.06,14.08,13.021,26.027,35.028,33]pentatriaconta-1(35),2(17),4(16),5,8,10,12,14,18,21(26),22,24,28,30,32-pentadecaene
CID 167580777
27,32-diazanonacyclo[17.15.1.02,17.04,16.06,14.08,13.021,26.027,35.028,33]pentatriaconta-1(35),2(17),4(16),5,8,10,12,14,18,21,23,25,28(33),29,31-pentadecaene
CID 167554141
1,33-diazanonacyclo[21.11.1.02,21.05,20.07,19.09,17.010,15.027,35.029,34]pentatriaconta-2(21),3,5(20),7,9(17),10,12,14,18,23,25,27(35),29(34),30,32-pentadecaene
CID 167649444
7,9,12-triazaheptacyclo[15.10.1.03,8.09,28.010,15.018,26.020,25]octacosa-1(27),3(8),4,6,10(15),11,13,17(28),18(26),20,22,24-dodecaene
CID 167534170
6,9,11-triazaheptacyclo[15.10.1.03,8.09,28.010,15.018,26.020,25]octacosa-1(27),3(8),4,6,10(15),11,13,17(28),18(26),20,22,24-dodecaene
CID 167568754
27,32-diazanonacyclo[17.15.1.02,17.03,15.04,12.05,10.021,26.027,35.028,33]pentatriaconta-1,3(15),4(12),5,7,9,13,17,19(35),21,23,25,28(33),29,31-pentadecaene
CID 167562075
10-[2-[5-[5-[2-(9H-acridin-10-yl)phenyl]-3-pyridinyl]-3-pyridinyl]phenyl]-9H-acridine
CID 122433695

Frequently Asked Questions

What is the IUPAC name of 10-[3-[2-(9H-acridin-10-yl)-3-pyridinyl]-2-pyridinyl]-9H-acridine?
The IUPAC name of 10-[3-[2-(9H-acridin-10-yl)-3-pyridinyl]-2-pyridinyl]-9H-acridine (CID 140910342) is 10-[3-[2-(9H-acridin-10-yl)-3-pyridinyl]-2-pyridinyl]-9H-acridine.
What is the SMILES notation for 10-[3-[2-(9H-acridin-10-yl)-3-pyridinyl]-2-pyridinyl]-9H-acridine?
The canonical SMILES for 10-[3-[2-(9H-acridin-10-yl)-3-pyridinyl]-2-pyridinyl]-9H-acridine is c1ccc2c(c1)Cc1ccccc1N2c1ncccc1-c1cccnc1N1c2ccccc2Cc2ccccc21.
What is the InChIKey of 10-[3-[2-(9H-acridin-10-yl)-3-pyridinyl]-2-pyridinyl]-9H-acridine?
The InChIKey is TWCCMEWQJQQTAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H26N4/c1-5-17-31-25(11-1)23-26-12-2-6-18-32(26)39(31)35-29(15-9-21-37-35)30-16-10-22-38-36(30)40-33-19-7-3-13-27(33)24-28-14-4-8-20-34(28)40/h1-22H,23-24H2.
What are the key properties of 10-[3-[2-(9H-acridin-10-yl)-3-pyridinyl]-2-pyridinyl]-9H-acridine?
10-[3-[2-(9H-acridin-10-yl)-3-pyridinyl]-2-pyridinyl]-9H-acridine has a molecular weight of 514.63 g/mol, XLogP of 8.89, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[3-[2-(9H-acridin-10-yl)-3-pyridinyl]-2-pyridinyl]-9H-acridine is sourced from PubChem (CID 140910342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).