1,3a,4,5,5a,6,6a,10a,10b,10c-decahydropyrrolo[3,4-c]carbazole

C14H18N2 — CID 70289249

IUPAC1,3a,4,5,5a,6,6a,10a,10b,10c-decahydropyrrolo[3,4-c]carbazole
SMILESC1=CC2NC3CCC4C=NCC4C3C2C=C1
InChIInChI=1S/C14H18N2/c1-2-4-12-10(3-1)14-11-8-15-7-9(11)5-6-13(14)16-12/h1-4,7,9-14,16H,5-6,8H2
InChIKeyMOJBMANVFAHESO-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.80
Rot. Bonds

About 1,3a,4,5,5a,6,6a,10a,10b,10c-decahydropyrrolo[3,4-c]carbazole

1,3a,4,5,5a,6,6a,10a,10b,10c-decahydropyrrolo[3,4-c]carbazole (PubChem CID 70289249) has the molecular formula C14H18N2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 1,3a,4,5,5a,6,6a,10a,10b,10c-decahydropyrrolo[3,4-c]carbazole.

Molecular Properties

Compound Name1,3a,4,5,5a,6,6a,10a,10b,10c-decahydropyrrolo[3,4-c]carbazole
PubChem CID70289249
Molecular FormulaC14H18N2
Molecular Weight214.31 g/mol
Exact Mass214.15
IUPAC Name1,3a,4,5,5a,6,6a,10a,10b,10c-decahydropyrrolo[3,4-c]carbazole
SMILESC1=CC2NC3CCC4C=NCC4C3C2C=C1
InChIInChI=1S/C14H18N2/c1-2-4-12-10(3-1)14-11-8-15-7-9(11)5-6-13(14)16-12/h1-4,7,9-14,16H,5-6,8H2
InChIKeyMOJBMANVFAHESO-UHFFFAOYSA-N
XLogP1.80
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,3a,4,5,5a,6,6a,10a,10b,10c-decahydropyrrolo[3,4-c]carbazole?
The IUPAC name of 1,3a,4,5,5a,6,6a,10a,10b,10c-decahydropyrrolo[3,4-c]carbazole (CID 70289249) is 1,3a,4,5,5a,6,6a,10a,10b,10c-decahydropyrrolo[3,4-c]carbazole.
What is the SMILES notation for 1,3a,4,5,5a,6,6a,10a,10b,10c-decahydropyrrolo[3,4-c]carbazole?
The canonical SMILES for 1,3a,4,5,5a,6,6a,10a,10b,10c-decahydropyrrolo[3,4-c]carbazole is C1=CC2NC3CCC4C=NCC4C3C2C=C1.
What is the InChIKey of 1,3a,4,5,5a,6,6a,10a,10b,10c-decahydropyrrolo[3,4-c]carbazole?
The InChIKey is MOJBMANVFAHESO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2/c1-2-4-12-10(3-1)14-11-8-15-7-9(11)5-6-13(14)16-12/h1-4,7,9-14,16H,5-6,8H2.
What are the key properties of 1,3a,4,5,5a,6,6a,10a,10b,10c-decahydropyrrolo[3,4-c]carbazole?
1,3a,4,5,5a,6,6a,10a,10b,10c-decahydropyrrolo[3,4-c]carbazole has a molecular weight of 214.31 g/mol, XLogP of 1.80, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3a,4,5,5a,6,6a,10a,10b,10c-decahydropyrrolo[3,4-c]carbazole is sourced from PubChem (CID 70289249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).