6-[2-(diethylamino)ethyl]-9-(1,3-oxazol-2-yl)-1,2-dihydrocyclopenta[c]carbazol-3-one

C24H25N3O2 — CID 90480070

IUPAC6-[2-(diethylamino)ethyl]-9-(1,3-oxazol-2-yl)-1,2-dihydrocyclopenta[c]carbazol-3-one
SMILESCCN(CC)CCn1c2ccc(-c3ncco3)cc2c2c3c(ccc21)C(=O)CC3
InChIInChI=1S/C24H25N3O2/c1-3-26(4-2)12-13-27-20-8-5-16(24-25-11-14-29-24)15-19(20)23-18-7-10-22(28)17(18)6-9-21(23)27/h5-6,8-9,11,14-15H,3-4,7,10,12-13H2,1-2H3
InChIKeyMYZWFKLETVRGQV-UHFFFAOYSA-N
MW387.48 g/mol
LogP4.92
Rot. Bonds6

About 6-[2-(diethylamino)ethyl]-9-(1,3-oxazol-2-yl)-1,2-dihydrocyclopenta[c]carbazol-3-one

6-[2-(diethylamino)ethyl]-9-(1,3-oxazol-2-yl)-1,2-dihydrocyclopenta[c]carbazol-3-one (PubChem CID 90480070) has the molecular formula C24H25N3O2 and a molecular weight of 387.48 g/mol. Its IUPAC name is 6-[2-(diethylamino)ethyl]-9-(1,3-oxazol-2-yl)-1,2-dihydrocyclopenta[c]carbazol-3-one.

Molecular Properties

Compound Name6-[2-(diethylamino)ethyl]-9-(1,3-oxazol-2-yl)-1,2-dihydrocyclopenta[c]carbazol-3-one
PubChem CID90480070
Molecular FormulaC24H25N3O2
Molecular Weight387.48 g/mol
Exact Mass387.19
IUPAC Name6-[2-(diethylamino)ethyl]-9-(1,3-oxazol-2-yl)-1,2-dihydrocyclopenta[c]carbazol-3-one
SMILESCCN(CC)CCn1c2ccc(-c3ncco3)cc2c2c3c(ccc21)C(=O)CC3
InChIInChI=1S/C24H25N3O2/c1-3-26(4-2)12-13-27-20-8-5-16(24-25-11-14-29-24)15-19(20)23-18-7-10-22(28)17(18)6-9-21(23)27/h5-6,8-9,11,14-15H,3-4,7,10,12-13H2,1-2H3
InChIKeyMYZWFKLETVRGQV-UHFFFAOYSA-N
XLogP4.92
TPSA51.27 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.48
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(diethylamino)ethyl]-9-(1,3-oxazol-2-yl)-1,2-dihydrocyclopenta[c]carbazol-3-one?
The IUPAC name of 6-[2-(diethylamino)ethyl]-9-(1,3-oxazol-2-yl)-1,2-dihydrocyclopenta[c]carbazol-3-one (CID 90480070) is 6-[2-(diethylamino)ethyl]-9-(1,3-oxazol-2-yl)-1,2-dihydrocyclopenta[c]carbazol-3-one.
What is the SMILES notation for 6-[2-(diethylamino)ethyl]-9-(1,3-oxazol-2-yl)-1,2-dihydrocyclopenta[c]carbazol-3-one?
The canonical SMILES for 6-[2-(diethylamino)ethyl]-9-(1,3-oxazol-2-yl)-1,2-dihydrocyclopenta[c]carbazol-3-one is CCN(CC)CCn1c2ccc(-c3ncco3)cc2c2c3c(ccc21)C(=O)CC3.
What is the InChIKey of 6-[2-(diethylamino)ethyl]-9-(1,3-oxazol-2-yl)-1,2-dihydrocyclopenta[c]carbazol-3-one?
The InChIKey is MYZWFKLETVRGQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O2/c1-3-26(4-2)12-13-27-20-8-5-16(24-25-11-14-29-24)15-19(20)23-18-7-10-22(28)17(18)6-9-21(23)27/h5-6,8-9,11,14-15H,3-4,7,10,12-13H2,1-2H3.
What are the key properties of 6-[2-(diethylamino)ethyl]-9-(1,3-oxazol-2-yl)-1,2-dihydrocyclopenta[c]carbazol-3-one?
6-[2-(diethylamino)ethyl]-9-(1,3-oxazol-2-yl)-1,2-dihydrocyclopenta[c]carbazol-3-one has a molecular weight of 387.48 g/mol, XLogP of 4.92, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(diethylamino)ethyl]-9-(1,3-oxazol-2-yl)-1,2-dihydrocyclopenta[c]carbazol-3-one is sourced from PubChem (CID 90480070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).