8-[(9-ethylcarbazol-3-yl)methyl]-1-methoxy-1,8-diazaspiro[4.5]decan-2-one

C24H29N3O2 — CID 71687450

IUPAC8-[(9-ethylcarbazol-3-yl)methyl]-1-methoxy-1,8-diazaspiro[4.5]decan-2-one
SMILESCCn1c2ccccc2c2cc(CN3CCC4(CCC(=O)N4OC)CC3)ccc21
InChIInChI=1S/C24H29N3O2/c1-3-26-21-7-5-4-6-19(21)20-16-18(8-9-22(20)26)17-25-14-12-24(13-15-25)11-10-23(28)27(24)29-2/h4-9,16H,3,10-15,17H2,1-2H3
InChIKeyUWYFUZNBLRYIAH-UHFFFAOYSA-N
MW391.52 g/mol
LogP4.33
Rot. Bonds4

About 8-[(9-ethylcarbazol-3-yl)methyl]-1-methoxy-1,8-diazaspiro[4.5]decan-2-one

8-[(9-ethylcarbazol-3-yl)methyl]-1-methoxy-1,8-diazaspiro[4.5]decan-2-one (PubChem CID 71687450) has the molecular formula C24H29N3O2 and a molecular weight of 391.52 g/mol. Its IUPAC name is 8-[(9-ethylcarbazol-3-yl)methyl]-1-methoxy-1,8-diazaspiro[4.5]decan-2-one.

Molecular Properties

Compound Name8-[(9-ethylcarbazol-3-yl)methyl]-1-methoxy-1,8-diazaspiro[4.5]decan-2-one
PubChem CID71687450
Molecular FormulaC24H29N3O2
Molecular Weight391.52 g/mol
Exact Mass391.23
IUPAC Name8-[(9-ethylcarbazol-3-yl)methyl]-1-methoxy-1,8-diazaspiro[4.5]decan-2-one
SMILESCCn1c2ccccc2c2cc(CN3CCC4(CCC(=O)N4OC)CC3)ccc21
InChIInChI=1S/C24H29N3O2/c1-3-26-21-7-5-4-6-19(21)20-16-18(8-9-22(20)26)17-25-14-12-24(13-15-25)11-10-23(28)27(24)29-2/h4-9,16H,3,10-15,17H2,1-2H3
InChIKeyUWYFUZNBLRYIAH-UHFFFAOYSA-N
XLogP4.33
TPSA37.71 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.52
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-[(9-ethylcarbazol-3-yl)methyl]-1-methoxy-1,8-diazaspiro[4.5]decan-2-one?
The IUPAC name of 8-[(9-ethylcarbazol-3-yl)methyl]-1-methoxy-1,8-diazaspiro[4.5]decan-2-one (CID 71687450) is 8-[(9-ethylcarbazol-3-yl)methyl]-1-methoxy-1,8-diazaspiro[4.5]decan-2-one.
What is the SMILES notation for 8-[(9-ethylcarbazol-3-yl)methyl]-1-methoxy-1,8-diazaspiro[4.5]decan-2-one?
The canonical SMILES for 8-[(9-ethylcarbazol-3-yl)methyl]-1-methoxy-1,8-diazaspiro[4.5]decan-2-one is CCn1c2ccccc2c2cc(CN3CCC4(CCC(=O)N4OC)CC3)ccc21.
What is the InChIKey of 8-[(9-ethylcarbazol-3-yl)methyl]-1-methoxy-1,8-diazaspiro[4.5]decan-2-one?
The InChIKey is UWYFUZNBLRYIAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N3O2/c1-3-26-21-7-5-4-6-19(21)20-16-18(8-9-22(20)26)17-25-14-12-24(13-15-25)11-10-23(28)27(24)29-2/h4-9,16H,3,10-15,17H2,1-2H3.
What are the key properties of 8-[(9-ethylcarbazol-3-yl)methyl]-1-methoxy-1,8-diazaspiro[4.5]decan-2-one?
8-[(9-ethylcarbazol-3-yl)methyl]-1-methoxy-1,8-diazaspiro[4.5]decan-2-one has a molecular weight of 391.52 g/mol, XLogP of 4.33, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(9-ethylcarbazol-3-yl)methyl]-1-methoxy-1,8-diazaspiro[4.5]decan-2-one is sourced from PubChem (CID 71687450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).