1-(1-methylcyclobutyl)-2,3,4,9-tetrahydro-1H-carbazole

C17H21N — CID 173177273

IUPAC1-(1-methylcyclobutyl)-2,3,4,9-tetrahydro-1H-carbazole
SMILESCC1(C2CCCc3c2[nH]c2ccccc32)CCC1
InChIInChI=1S/C17H21N/c1-17(10-5-11-17)14-8-4-7-13-12-6-2-3-9-15(12)18-16(13)14/h2-3,6,9,14,18H,4-5,7-8,10-11H2,1H3
InChIKeyZPDITTCOSRJVRN-UHFFFAOYSA-N
MW239.36 g/mol
LogP4.78
Rot. Bonds1

About 1-(1-methylcyclobutyl)-2,3,4,9-tetrahydro-1H-carbazole

1-(1-methylcyclobutyl)-2,3,4,9-tetrahydro-1H-carbazole (PubChem CID 173177273) has the molecular formula C17H21N and a molecular weight of 239.36 g/mol. Its IUPAC name is 1-(1-methylcyclobutyl)-2,3,4,9-tetrahydro-1H-carbazole.

Molecular Properties

Compound Name1-(1-methylcyclobutyl)-2,3,4,9-tetrahydro-1H-carbazole
PubChem CID173177273
Molecular FormulaC17H21N
Molecular Weight239.36 g/mol
Exact Mass239.17
IUPAC Name1-(1-methylcyclobutyl)-2,3,4,9-tetrahydro-1H-carbazole
SMILESCC1(C2CCCc3c2[nH]c2ccccc32)CCC1
InChIInChI=1S/C17H21N/c1-17(10-5-11-17)14-8-4-7-13-12-6-2-3-9-15(12)18-16(13)14/h2-3,6,9,14,18H,4-5,7-8,10-11H2,1H3
InChIKeyZPDITTCOSRJVRN-UHFFFAOYSA-N
XLogP4.78
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

1-(1-methylcyclodecyl)-2,3,4,9-tetrahydro-1H-carbazole
CID 91059771
2,3,4,9-tetrahydro-1H-carbazole-1-thiol
CID 138599371
1-phenyl-2,3,4,9-tetrahydro-1H-carbazole
CID 20568385
1-cyclobutyl-2,3,4,9-tetrahydro-1H-carbazole
CID 91153684
[(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]methanamine
CID 26342575
N-benzyl-N-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine
CID 159520401
N-propyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine
CID 11219296
N-cyclopentyl-2,3,4,9-tetrahydro-1H-carbazol-1-amine
CID 65333592
N-(2,2-dimethylpropyl)-2,3,4,9-tetrahydro-1H-carbazol-1-amine
CID 65334003
(6aR,10aS)-10a-methyl-5,6,6a,7,8,9,10,11-octahydrobenzo[b]carbazole
CID 134909159
2-[1-[(2,3,4,9-tetrahydro-1H-carbazol-1-ylamino)methyl]cyclopropyl]ethanol
CID 114756055
1-(2-fluoro-5-methylphenyl)-2,3,4,9-tetrahydro-1H-carbazole
CID 144635072

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylcyclobutyl)-2,3,4,9-tetrahydro-1H-carbazole?
The IUPAC name of 1-(1-methylcyclobutyl)-2,3,4,9-tetrahydro-1H-carbazole (CID 173177273) is 1-(1-methylcyclobutyl)-2,3,4,9-tetrahydro-1H-carbazole.
What is the SMILES notation for 1-(1-methylcyclobutyl)-2,3,4,9-tetrahydro-1H-carbazole?
The canonical SMILES for 1-(1-methylcyclobutyl)-2,3,4,9-tetrahydro-1H-carbazole is CC1(C2CCCc3c2[nH]c2ccccc32)CCC1.
What is the InChIKey of 1-(1-methylcyclobutyl)-2,3,4,9-tetrahydro-1H-carbazole?
The InChIKey is ZPDITTCOSRJVRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N/c1-17(10-5-11-17)14-8-4-7-13-12-6-2-3-9-15(12)18-16(13)14/h2-3,6,9,14,18H,4-5,7-8,10-11H2,1H3.
What are the key properties of 1-(1-methylcyclobutyl)-2,3,4,9-tetrahydro-1H-carbazole?
1-(1-methylcyclobutyl)-2,3,4,9-tetrahydro-1H-carbazole has a molecular weight of 239.36 g/mol, XLogP of 4.78, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylcyclobutyl)-2,3,4,9-tetrahydro-1H-carbazole is sourced from PubChem (CID 173177273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).