9-ethyl-1,2,3,4,4a,4b,5,6,7,9a-decahydrocarbazole

C14H23N — CID 69282469

IUPAC9-ethyl-1,2,3,4,4a,4b,5,6,7,9a-decahydrocarbazole
SMILESCCN1C2=CCCCC2C2CCCCC21
InChIInChI=1S/C14H23N/c1-2-15-13-9-5-3-7-11(13)12-8-4-6-10-14(12)15/h9,11-12,14H,2-8,10H2,1H3
InChIKeyIXLBSJYSIZSCPW-UHFFFAOYSA-N
MW205.34 g/mol
LogP3.56
Rot. Bonds1

About 9-ethyl-1,2,3,4,4a,4b,5,6,7,9a-decahydrocarbazole

9-ethyl-1,2,3,4,4a,4b,5,6,7,9a-decahydrocarbazole (PubChem CID 69282469) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is 9-ethyl-1,2,3,4,4a,4b,5,6,7,9a-decahydrocarbazole.

Molecular Properties

Compound Name9-ethyl-1,2,3,4,4a,4b,5,6,7,9a-decahydrocarbazole
PubChem CID69282469
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC Name9-ethyl-1,2,3,4,4a,4b,5,6,7,9a-decahydrocarbazole
SMILESCCN1C2=CCCCC2C2CCCCC21
InChIInChI=1S/C14H23N/c1-2-15-13-9-5-3-7-11(13)12-8-4-6-10-14(12)15/h9,11-12,14H,2-8,10H2,1H3
InChIKeyIXLBSJYSIZSCPW-UHFFFAOYSA-N
XLogP3.56
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 9-ethyl-1,2,3,4,4a,4b,5,6,7,9a-decahydrocarbazole?
The IUPAC name of 9-ethyl-1,2,3,4,4a,4b,5,6,7,9a-decahydrocarbazole (CID 69282469) is 9-ethyl-1,2,3,4,4a,4b,5,6,7,9a-decahydrocarbazole.
What is the SMILES notation for 9-ethyl-1,2,3,4,4a,4b,5,6,7,9a-decahydrocarbazole?
The canonical SMILES for 9-ethyl-1,2,3,4,4a,4b,5,6,7,9a-decahydrocarbazole is CCN1C2=CCCCC2C2CCCCC21.
What is the InChIKey of 9-ethyl-1,2,3,4,4a,4b,5,6,7,9a-decahydrocarbazole?
The InChIKey is IXLBSJYSIZSCPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-2-15-13-9-5-3-7-11(13)12-8-4-6-10-14(12)15/h9,11-12,14H,2-8,10H2,1H3.
What are the key properties of 9-ethyl-1,2,3,4,4a,4b,5,6,7,9a-decahydrocarbazole?
9-ethyl-1,2,3,4,4a,4b,5,6,7,9a-decahydrocarbazole has a molecular weight of 205.34 g/mol, XLogP of 3.56, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-1,2,3,4,4a,4b,5,6,7,9a-decahydrocarbazole is sourced from PubChem (CID 69282469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).