1-cyclobutyl-2,3,4,9-tetrahydro-1H-carbazole

C16H19N — CID 91153684

IUPAC1-cyclobutyl-2,3,4,9-tetrahydro-1H-carbazole
SMILESc1ccc2c3c([nH]c2c1)C(C1CCC1)CCC3
InChIInChI=1S/C16H19N/c1-2-10-15-13(7-1)14-9-4-8-12(16(14)17-15)11-5-3-6-11/h1-2,7,10-12,17H,3-6,8-9H2
InChIKeyZWKAMJIIUYKMKU-UHFFFAOYSA-N
MW225.34 g/mol
LogP4.39
Rot. Bonds1

About 1-cyclobutyl-2,3,4,9-tetrahydro-1H-carbazole

1-cyclobutyl-2,3,4,9-tetrahydro-1H-carbazole (PubChem CID 91153684) has the molecular formula C16H19N and a molecular weight of 225.34 g/mol. Its IUPAC name is 1-cyclobutyl-2,3,4,9-tetrahydro-1H-carbazole.

Molecular Properties

Compound Name1-cyclobutyl-2,3,4,9-tetrahydro-1H-carbazole
PubChem CID91153684
Molecular FormulaC16H19N
Molecular Weight225.34 g/mol
Exact Mass225.15
IUPAC Name1-cyclobutyl-2,3,4,9-tetrahydro-1H-carbazole
SMILESc1ccc2c3c([nH]c2c1)C(C1CCC1)CCC3
InChIInChI=1S/C16H19N/c1-2-10-15-13(7-1)14-9-4-8-12(16(14)17-15)11-5-3-6-11/h1-2,7,10-12,17H,3-6,8-9H2
InChIKeyZWKAMJIIUYKMKU-UHFFFAOYSA-N
XLogP4.39
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

2,3,4,9-tetrahydro-1H-carbazole-1-thiol
CID 138599371
1-phenyl-2,3,4,9-tetrahydro-1H-carbazole
CID 20568385
[(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]methanamine
CID 26342575
1-cyclobutyl-2-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indole
CID 141010489
1-cyclobutyl-1,2,3,4-tetrahydrocyclopenta[b]indole
CID 173177006
1-(1-methylcyclobutyl)-2,3,4,9-tetrahydro-1H-carbazole
CID 173177273
N-cyclopentyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine
CID 65333592
1-(1-methylcyclodecyl)-2,3,4,9-tetrahydro-1H-carbazole
CID 91059771
(1R,16S,21R)-3,13-diazapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-2(10),4,6,8-tetraen-20-one
CID 10125500
phenyl(2,3,4,9-tetrahydro-1H-carbazol-1-yl)diazene
CID 139602071
N-benzyl-N-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine
CID 159520401
N-(2-chlorophenyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine
CID 65333996

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-2,3,4,9-tetrahydro-1H-carbazole?
The IUPAC name of 1-cyclobutyl-2,3,4,9-tetrahydro-1H-carbazole (CID 91153684) is 1-cyclobutyl-2,3,4,9-tetrahydro-1H-carbazole.
What is the SMILES notation for 1-cyclobutyl-2,3,4,9-tetrahydro-1H-carbazole?
The canonical SMILES for 1-cyclobutyl-2,3,4,9-tetrahydro-1H-carbazole is c1ccc2c3c([nH]c2c1)C(C1CCC1)CCC3.
What is the InChIKey of 1-cyclobutyl-2,3,4,9-tetrahydro-1H-carbazole?
The InChIKey is ZWKAMJIIUYKMKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N/c1-2-10-15-13(7-1)14-9-4-8-12(16(14)17-15)11-5-3-6-11/h1-2,7,10-12,17H,3-6,8-9H2.
What are the key properties of 1-cyclobutyl-2,3,4,9-tetrahydro-1H-carbazole?
1-cyclobutyl-2,3,4,9-tetrahydro-1H-carbazole has a molecular weight of 225.34 g/mol, XLogP of 4.39, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-2,3,4,9-tetrahydro-1H-carbazole is sourced from PubChem (CID 91153684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).