9-ethyl-3-[[(1R,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methyl]carbazole

C25H32N2 — CID 7012437

IUPAC9-ethyl-3-[[(1R,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methyl]carbazole
SMILESCCn1c2ccccc2c2cc(CN3C[C@@]4(C)C[C@H]3CC(C)(C)C4)ccc21
InChIInChI=1S/C25H32N2/c1-5-27-22-9-7-6-8-20(22)21-12-18(10-11-23(21)27)15-26-17-25(4)14-19(26)13-24(2,3)16-25/h6-12,19H,5,13-17H2,1-4H3/t19-,25+/m1/s1
InChIKeyYERVCDSICSEZGX-CLOONOSVSA-N
MW360.55 g/mol
LogP6.22
Rot. Bonds3

About 9-ethyl-3-[[(1R,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methyl]carbazole

9-ethyl-3-[[(1R,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methyl]carbazole (PubChem CID 7012437) has the molecular formula C25H32N2 and a molecular weight of 360.55 g/mol. Its IUPAC name is 9-ethyl-3-[[(1R,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methyl]carbazole.

Molecular Properties

Compound Name9-ethyl-3-[[(1R,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methyl]carbazole
PubChem CID7012437
Molecular FormulaC25H32N2
Molecular Weight360.55 g/mol
Exact Mass360.26
IUPAC Name9-ethyl-3-[[(1R,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methyl]carbazole
SMILESCCn1c2ccccc2c2cc(CN3C[C@@]4(C)C[C@H]3CC(C)(C)C4)ccc21
InChIInChI=1S/C25H32N2/c1-5-27-22-9-7-6-8-20(22)21-12-18(10-11-23(21)27)15-26-17-25(4)14-19(26)13-24(2,3)16-25/h6-12,19H,5,13-17H2,1-4H3/t19-,25+/m1/s1
InChIKeyYERVCDSICSEZGX-CLOONOSVSA-N
XLogP6.22
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.55
LogP ≤ 56.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 9-ethyl-3-[[(1R,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methyl]carbazole with MolForge

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Related Compounds

9-ethyl-3-(piperazin-1-ylmethyl)carbazole;hydrochloride
CID 156592203
9-ethyl-3-(piperazin-1-ylmethyl)carbazole;dihydrochloride
CID 75531489
[2-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)methyl]phenyl]methanamine
CID 82135544
3-[(1-cyclohexyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methyl]-9-ethylcarbazole
CID 10001915
3-[[(3R,5R)-3,5-dimethylpiperidin-1-yl]methyl]-9-ethylcarbazole
CID 1378344
(2R)-1-(3,6-dichlorocarbazol-9-yl)-3-[(1S,5S)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]propan-2-ol
CID 98671631
N-[(9-ethylcarbazol-3-yl)methyl]adamantan-1-amine
CID 2852735
9-ethyl-3-[(4-phenylpiperazin-1-yl)methyl]carbazole
CID 2058524
N,N-bis[(9-ethylcarbazol-3-yl)methyl]ethanamine
CID 160567842
1'-[(9-ethylcarbazol-3-yl)methyl]spiro[1,2-dihydroindene-3,4'-piperidine]-1-ol
CID 57400177
3-(9-ethylcarbazol-3-yl)propan-1-ol
CID 117386651
1-(9-ethylcarbazol-3-yl)propan-2-ol
CID 117386647

Frequently Asked Questions

What is the IUPAC name of 9-ethyl-3-[[(1R,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methyl]carbazole?
The IUPAC name of 9-ethyl-3-[[(1R,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methyl]carbazole (CID 7012437) is 9-ethyl-3-[[(1R,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methyl]carbazole.
What is the SMILES notation for 9-ethyl-3-[[(1R,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methyl]carbazole?
The canonical SMILES for 9-ethyl-3-[[(1R,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methyl]carbazole is CCn1c2ccccc2c2cc(CN3C[C@@]4(C)C[C@H]3CC(C)(C)C4)ccc21.
What is the InChIKey of 9-ethyl-3-[[(1R,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methyl]carbazole?
The InChIKey is YERVCDSICSEZGX-CLOONOSVSA-N. The full InChI is InChI=1S/C25H32N2/c1-5-27-22-9-7-6-8-20(22)21-12-18(10-11-23(21)27)15-26-17-25(4)14-19(26)13-24(2,3)16-25/h6-12,19H,5,13-17H2,1-4H3/t19-,25+/m1/s1.
What are the key properties of 9-ethyl-3-[[(1R,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methyl]carbazole?
9-ethyl-3-[[(1R,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methyl]carbazole has a molecular weight of 360.55 g/mol, XLogP of 6.22, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-3-[[(1R,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]methyl]carbazole is sourced from PubChem (CID 7012437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).