1-cyclopropyl-5-fluoro-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;1-ethyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;4-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;5-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-propan-2-yl-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-prop-1-en-2-yl-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine

C121H121F3N30 — CID 159853588

About 1-cyclopropyl-5-fluoro-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;1-ethyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;4-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;5-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-propan-2-yl-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-prop-1-en-2-yl-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine

1-cyclopropyl-5-fluoro-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;1-ethyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;4-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;5-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-propan-2-yl-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-prop-1-en-2-yl-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine (PubChem CID 159853588) has the molecular formula C121H121F3N30 and a molecular weight of 2052.50 g/mol. Its IUPAC name is 1-cyclopropyl-5-fluoro-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;1-ethyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;4-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;5-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-propan-2-yl-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-prop-1-en-2-yl-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine.

Molecular Properties

• Compound Name: 1-cyclopropyl-5-fluoro-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;1-ethyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;4-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;5-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-propan-2-yl-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-prop-1-en-2-yl-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine
• PubChem CID: 159853588
• Molecular Formula: C121H121F3N30
• Molecular Weight: 2052.50 g/mol
• Exact Mass: 2051.03
• IUPAC Name: 1-cyclopropyl-5-fluoro-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;1-ethyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;4-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;5-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-propan-2-yl-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-prop-1-en-2-yl-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine
• SMILES: C=C(C)c1n[nH]c2ccc3nc(-c4cn[nH]c4C)c4c(c3c12)CCCC4.CCc1[nH]nc2ccc3nc(-c4cn[nH]c4C)c4c(c3c12)CCCC4.Cc1[nH]ncc1-c1nc2c(F)cc3n[nH]c(C)c3c2c2c1CCCC2.Cc1[nH]ncc1-c1nc2c(F)cc3n[nH]c(C4CC4)c3c2c2c1CCCC2.Cc1[nH]ncc1-c1nc2cc(F)c3n[nH]c(C)c3c2c2c1CCCC2.Cc1[nH]ncc1-c1nc2ccc3n[nH]c(C(C)C)c3c2c2c1CCCC2
• InChI: InChI=1S/C21H20FN5.C21H23N5.C21H21N5.C20H21N5.2C19H18FN5/c1-10-14(9-23-25-10)20-13-5-3-2-4-12(13)17-18-16(8-15(22)21(17)24-20)26-27-19(18)11-6-7-11;2*1-11(2)20-19-17(25-26-20)9-8-16-18(19)13-6-4-5-7-14(13)21(23-16)15-10-22-24-12(15)3;1-3-15-19-17(25-24-15)9-8-16-18(19)12-6-4-5-7-13(12)20(22-16)14-10-21-23-11(14)2;1-9-13(8-21-23-9)18-12-6-4-3-5-11(12)17-15(22-18)7-14(20)19-16(17)10(2)24-25-19;1-9-13(8-21-23-9)18-12-6-4-3-5-11(12)17-16-10(2)24-25-15(16)7-14(20)19(17)22-18/h8-9,11H,2-7H2,1H3,(H,23,25)(H,26,27);8-11H,4-7H2,1-3H3,(H,22,24)(H,25,26);8-10H,1,4-7H2,2-3H3,(H,22,24)(H,25,26);8-10H,3-7H2,1-2H3,(H,21,23)(H,24,25);2*7-8H,3-6H2,1-2H3,(H,21,23)(H,24,25)
• InChIKey: NQGAXRYSGLCBLJ-UHFFFAOYSA-N
• XLogP: 26.76
• TPSA: 421.50 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 18
• Rotatable Bonds: 10
• Heavy Atoms: 154
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2052.50
LogP ≤ 5	26.76
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	18

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-5-fluoro-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;1-ethyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;4-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;5-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-propan-2-yl-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-prop-1-en-2-yl-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine?

The IUPAC name of 1-cyclopropyl-5-fluoro-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;1-ethyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;4-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;5-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-propan-2-yl-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-prop-1-en-2-yl-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine (CID 159853588) is 1-cyclopropyl-5-fluoro-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;1-ethyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;4-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;5-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-propan-2-yl-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-prop-1-en-2-yl-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine.

What is the SMILES notation for 1-cyclopropyl-5-fluoro-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;1-ethyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;4-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;5-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-propan-2-yl-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-prop-1-en-2-yl-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine?

The canonical SMILES for 1-cyclopropyl-5-fluoro-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;1-ethyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;4-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;5-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-propan-2-yl-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-prop-1-en-2-yl-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine is C=C(C)c1n[nH]c2ccc3nc(-c4cn[nH]c4C)c4c(c3c12)CCCC4.CCc1[nH]nc2ccc3nc(-c4cn[nH]c4C)c4c(c3c12)CCCC4.Cc1[nH]ncc1-c1nc2c(F)cc3n[nH]c(C)c3c2c2c1CCCC2.Cc1[nH]ncc1-c1nc2c(F)cc3n[nH]c(C4CC4)c3c2c2c1CCCC2.Cc1[nH]ncc1-c1nc2cc(F)c3n[nH]c(C)c3c2c2c1CCCC2.Cc1[nH]ncc1-c1nc2ccc3n[nH]c(C(C)C)c3c2c2c1CCCC2.

What is the InChIKey of 1-cyclopropyl-5-fluoro-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;1-ethyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;4-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;5-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-propan-2-yl-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-prop-1-en-2-yl-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine?

The InChIKey is NQGAXRYSGLCBLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20FN5.C21H23N5.C21H21N5.C20H21N5.2C19H18FN5/c1-10-14(9-23-25-10)20-13-5-3-2-4-12(13)17-18-16(8-15(22)21(17)24-20)26-27-19(18)11-6-7-11;2*1-11(2)20-19-17(25-26-20)9-8-16-18(19)13-6-4-5-7-14(13)21(23-16)15-10-22-24-12(15)3;1-3-15-19-17(25-24-15)9-8-16-18(19)12-6-4-5-7-13(12)20(22-16)14-10-21-23-11(14)2;1-9-13(8-21-23-9)18-12-6-4-3-5-11(12)17-15(22-18)7-14(20)19-16(17)10(2)24-25-19;1-9-13(8-21-23-9)18-12-6-4-3-5-11(12)17-16-10(2)24-25-15(16)7-14(20)19(17)22-18/h8-9,11H,2-7H2,1H3,(H,23,25)(H,26,27);8-11H,4-7H2,1-3H3,(H,22,24)(H,25,26);8-10H,1,4-7H2,2-3H3,(H,22,24)(H,25,26);8-10H,3-7H2,1-2H3,(H,21,23)(H,24,25);2*7-8H,3-6H2,1-2H3,(H,21,23)(H,24,25).

What are the key properties of 1-cyclopropyl-5-fluoro-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;1-ethyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;4-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;5-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-propan-2-yl-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-prop-1-en-2-yl-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine?

1-cyclopropyl-5-fluoro-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;1-ethyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;4-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;5-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-propan-2-yl-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-prop-1-en-2-yl-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine has a molecular weight of 2052.50 g/mol, XLogP of 26.76, 10 rotatable bonds, 12 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for 1-cyclopropyl-5-fluoro-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;1-ethyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;4-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;5-fluoro-1-methyl-7-(5-methyl-1H-pyrazol-4-yl)-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-propan-2-yl-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridine;7-(5-methyl-1H-pyrazol-4-yl)-1-prop-1-en-2-yl-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridine is sourced from PubChem (CID 159853588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).