8-[(9-ethylcarbazol-3-yl)methyl]-1-methyl-3-propan-2-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione

C26H32N4O2 — CID 26222110

IUPAC8-[(9-ethylcarbazol-3-yl)methyl]-1-methyl-3-propan-2-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione
SMILESCCn1c2ccccc2c2cc(CN3CCC4(CC3)C(=O)N(C(C)C)C(=O)N4C)ccc21
InChIInChI=1S/C26H32N4O2/c1-5-29-22-9-7-6-8-20(22)21-16-19(10-11-23(21)29)17-28-14-12-26(13-15-28)24(31)30(18(2)3)25(32)27(26)4/h6-11,16,18H,5,12-15,17H2,1-4H3
InChIKeyZWKNPTHNMFYBMT-UHFFFAOYSA-N
MW432.57 g/mol
LogP4.45
Rot. Bonds4

About 8-[(9-ethylcarbazol-3-yl)methyl]-1-methyl-3-propan-2-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione

8-[(9-ethylcarbazol-3-yl)methyl]-1-methyl-3-propan-2-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione (PubChem CID 26222110) has the molecular formula C26H32N4O2 and a molecular weight of 432.57 g/mol. Its IUPAC name is 8-[(9-ethylcarbazol-3-yl)methyl]-1-methyl-3-propan-2-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione.

Molecular Properties

Compound Name8-[(9-ethylcarbazol-3-yl)methyl]-1-methyl-3-propan-2-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione
PubChem CID26222110
Molecular FormulaC26H32N4O2
Molecular Weight432.57 g/mol
Exact Mass432.25
IUPAC Name8-[(9-ethylcarbazol-3-yl)methyl]-1-methyl-3-propan-2-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione
SMILESCCn1c2ccccc2c2cc(CN3CCC4(CC3)C(=O)N(C(C)C)C(=O)N4C)ccc21
InChIInChI=1S/C26H32N4O2/c1-5-29-22-9-7-6-8-20(22)21-16-19(10-11-23(21)29)17-28-14-12-26(13-15-28)24(31)30(18(2)3)25(32)27(26)4/h6-11,16,18H,5,12-15,17H2,1-4H3
InChIKeyZWKNPTHNMFYBMT-UHFFFAOYSA-N
XLogP4.45
TPSA48.79 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.57
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 8-[(9-ethylcarbazol-3-yl)methyl]-1-methyl-3-propan-2-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione?
The IUPAC name of 8-[(9-ethylcarbazol-3-yl)methyl]-1-methyl-3-propan-2-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione (CID 26222110) is 8-[(9-ethylcarbazol-3-yl)methyl]-1-methyl-3-propan-2-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione.
What is the SMILES notation for 8-[(9-ethylcarbazol-3-yl)methyl]-1-methyl-3-propan-2-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione?
The canonical SMILES for 8-[(9-ethylcarbazol-3-yl)methyl]-1-methyl-3-propan-2-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione is CCn1c2ccccc2c2cc(CN3CCC4(CC3)C(=O)N(C(C)C)C(=O)N4C)ccc21.
What is the InChIKey of 8-[(9-ethylcarbazol-3-yl)methyl]-1-methyl-3-propan-2-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione?
The InChIKey is ZWKNPTHNMFYBMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H32N4O2/c1-5-29-22-9-7-6-8-20(22)21-16-19(10-11-23(21)29)17-28-14-12-26(13-15-28)24(31)30(18(2)3)25(32)27(26)4/h6-11,16,18H,5,12-15,17H2,1-4H3.
What are the key properties of 8-[(9-ethylcarbazol-3-yl)methyl]-1-methyl-3-propan-2-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione?
8-[(9-ethylcarbazol-3-yl)methyl]-1-methyl-3-propan-2-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione has a molecular weight of 432.57 g/mol, XLogP of 4.45, 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-methyl-3-propan-2-yl-1,3,8-triazaspiro[4.5]decane-2,4-dione is sourced from PubChem (CID 26222110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).