[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-methoxyphenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-methoxyphenyl)ethyl]piperazin-1-yl]methanone

C126H154F2N16O6 — CID 160768802

IUPAC[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-methoxyphenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-methoxyphenyl)ethyl]piperazin-1-yl]methanone
SMILESCCN(CC)CCCn1c2ccccc2c2cc(C(=O)N3CCN(CCc4ccc(F)cc4)CC3)ccc21.CCN(CC)CCCn1c2ccccc2c2cc(C(=O)N3CCN(CCc4ccc(OC)cc4)CC3)ccc21.CN(C)CCCn1c2ccccc2c2cc(C(=O)N3CCN(CCc4cccc(F)c4)CC3)ccc21.COc1cccc(CCN2CCN(C(=O)c3ccc4c(c3)c3ccccc3n4CCCN(C)C)CC2)c1
InChIInChI=1S/C33H42N4O2.C32H39FN4O.C31H38N4O2.C30H35FN4O/c1-4-34(5-2)18-8-19-37-31-10-7-6-9-29(31)30-25-27(13-16-32(30)37)33(38)36-23-21-35(22-24-36)20-17-26-11-14-28(39-3)15-12-26;1-3-34(4-2)17-7-18-37-30-9-6-5-8-28(30)29-24-26(12-15-31(29)37)32(38)36-22-20-35(21-23-36)19-16-25-10-13-27(33)14-11-25;1-32(2)15-7-16-35-29-11-5-4-10-27(29)28-23-25(12-13-30(28)35)31(36)34-20-18-33(19-21-34)17-14-24-8-6-9-26(22-24)37-3;1-32(2)14-6-15-35-28-10-4-3-9-26(28)27-22-24(11-12-29(27)35)30(36)34-19-17-33(18-20-34)16-13-23-7-5-8-25(31)21-23/h6-7,9-16,25H,4-5,8,17-24H2,1-3H3;5-6,8-15,24H,3-4,7,16-23H2,1-2H3;4-6,8-13,22-23H,7,14-21H2,1-3H3;3-5,7-12,21-22H,6,13-20H2,1-2H3
InChIKeyRZAPNKPXWFKJGH-UHFFFAOYSA-N
MW2026.72 g/mol
LogP20.84
Rot. Bonds38

About [9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-methoxyphenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-methoxyphenyl)ethyl]piperazin-1-yl]methanone

[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-methoxyphenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-methoxyphenyl)ethyl]piperazin-1-yl]methanone (PubChem CID 160768802) has the molecular formula C126H154F2N16O6 and a molecular weight of 2026.72 g/mol. Its IUPAC name is [9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-methoxyphenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-methoxyphenyl)ethyl]piperazin-1-yl]methanone.

Molecular Properties

Compound Name[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-methoxyphenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-methoxyphenyl)ethyl]piperazin-1-yl]methanone
PubChem CID160768802
Molecular FormulaC126H154F2N16O6
Molecular Weight2026.72 g/mol
Exact Mass2025.22
IUPAC Name[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-methoxyphenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-methoxyphenyl)ethyl]piperazin-1-yl]methanone
SMILESCCN(CC)CCCn1c2ccccc2c2cc(C(=O)N3CCN(CCc4ccc(F)cc4)CC3)ccc21.CCN(CC)CCCn1c2ccccc2c2cc(C(=O)N3CCN(CCc4ccc(OC)cc4)CC3)ccc21.CN(C)CCCn1c2ccccc2c2cc(C(=O)N3CCN(CCc4cccc(F)c4)CC3)ccc21.COc1cccc(CCN2CCN(C(=O)c3ccc4c(c3)c3ccccc3n4CCCN(C)C)CC2)c1
InChIInChI=1S/C33H42N4O2.C32H39FN4O.C31H38N4O2.C30H35FN4O/c1-4-34(5-2)18-8-19-37-31-10-7-6-9-29(31)30-25-27(13-16-32(30)37)33(38)36-23-21-35(22-24-36)20-17-26-11-14-28(39-3)15-12-26;1-3-34(4-2)17-7-18-37-30-9-6-5-8-28(30)29-24-26(12-15-31(29)37)32(38)36-22-20-35(21-23-36)19-16-25-10-13-27(33)14-11-25;1-32(2)15-7-16-35-29-11-5-4-10-27(29)28-23-25(12-13-30(28)35)31(36)34-20-18-33(19-21-34)17-14-24-8-6-9-26(22-24)37-3;1-32(2)14-6-15-35-28-10-4-3-9-26(28)27-22-24(11-12-29(27)35)30(36)34-19-17-33(18-20-34)16-13-23-7-5-8-25(31)21-23/h6-7,9-16,25H,4-5,8,17-24H2,1-3H3;5-6,8-15,24H,3-4,7,16-23H2,1-2H3;4-6,8-13,22-23H,7,14-21H2,1-3H3;3-5,7-12,21-22H,6,13-20H2,1-2H3
InChIKeyRZAPNKPXWFKJGH-UHFFFAOYSA-N
XLogP20.84
TPSA145.34 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds38
Heavy Atoms150
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002026.72
LogP ≤ 520.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze [9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-methoxyphenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-methoxyphenyl)ethyl]piperazin-1-yl]methanone with MolForge

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Frequently Asked Questions

What is the IUPAC name of [9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-methoxyphenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-methoxyphenyl)ethyl]piperazin-1-yl]methanone?
The IUPAC name of [9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-methoxyphenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-methoxyphenyl)ethyl]piperazin-1-yl]methanone (CID 160768802) is [9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-methoxyphenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-methoxyphenyl)ethyl]piperazin-1-yl]methanone.
What is the SMILES notation for [9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-methoxyphenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-methoxyphenyl)ethyl]piperazin-1-yl]methanone?
The canonical SMILES for [9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-methoxyphenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-methoxyphenyl)ethyl]piperazin-1-yl]methanone is CCN(CC)CCCn1c2ccccc2c2cc(C(=O)N3CCN(CCc4ccc(F)cc4)CC3)ccc21.CCN(CC)CCCn1c2ccccc2c2cc(C(=O)N3CCN(CCc4ccc(OC)cc4)CC3)ccc21.CN(C)CCCn1c2ccccc2c2cc(C(=O)N3CCN(CCc4cccc(F)c4)CC3)ccc21.COc1cccc(CCN2CCN(C(=O)c3ccc4c(c3)c3ccccc3n4CCCN(C)C)CC2)c1.
What is the InChIKey of [9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-methoxyphenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-methoxyphenyl)ethyl]piperazin-1-yl]methanone?
The InChIKey is RZAPNKPXWFKJGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H42N4O2.C32H39FN4O.C31H38N4O2.C30H35FN4O/c1-4-34(5-2)18-8-19-37-31-10-7-6-9-29(31)30-25-27(13-16-32(30)37)33(38)36-23-21-35(22-24-36)20-17-26-11-14-28(39-3)15-12-26;1-3-34(4-2)17-7-18-37-30-9-6-5-8-28(30)29-24-26(12-15-31(29)37)32(38)36-22-20-35(21-23-36)19-16-25-10-13-27(33)14-11-25;1-32(2)15-7-16-35-29-11-5-4-10-27(29)28-23-25(12-13-30(28)35)31(36)34-20-18-33(19-21-34)17-14-24-8-6-9-26(22-24)37-3;1-32(2)14-6-15-35-28-10-4-3-9-26(28)27-22-24(11-12-29(27)35)30(36)34-19-17-33(18-20-34)16-13-23-7-5-8-25(31)21-23/h6-7,9-16,25H,4-5,8,17-24H2,1-3H3;5-6,8-15,24H,3-4,7,16-23H2,1-2H3;4-6,8-13,22-23H,7,14-21H2,1-3H3;3-5,7-12,21-22H,6,13-20H2,1-2H3.
What are the key properties of [9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-methoxyphenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-methoxyphenyl)ethyl]piperazin-1-yl]methanone?
[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-methoxyphenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-methoxyphenyl)ethyl]piperazin-1-yl]methanone has a molecular weight of 2026.72 g/mol, XLogP of 20.84, 38 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for [9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(diethylamino)propyl]carbazol-3-yl]-[4-[2-(4-methoxyphenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-fluorophenyl)ethyl]piperazin-1-yl]methanone;[9-[3-(dimethylamino)propyl]carbazol-3-yl]-[4-[2-(3-methoxyphenyl)ethyl]piperazin-1-yl]methanone is sourced from PubChem (CID 160768802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).