11-propan-2-ylbenzo[a]carbazole

C19H17N — CID 118058944

IUPAC11-propan-2-ylbenzo[a]carbazole
SMILESCC(C)n1c2ccccc2c2ccc3ccccc3c21
InChIInChI=1S/C19H17N/c1-13(2)20-18-10-6-5-9-16(18)17-12-11-14-7-3-4-8-15(14)19(17)20/h3-13H,1-2H3
InChIKeyUASNEYAOYKSGNU-UHFFFAOYSA-N
MW259.35 g/mol
LogP5.53
Rot. Bonds1

About 11-propan-2-ylbenzo[a]carbazole

11-propan-2-ylbenzo[a]carbazole (PubChem CID 118058944) has the molecular formula C19H17N and a molecular weight of 259.35 g/mol. Its IUPAC name is 11-propan-2-ylbenzo[a]carbazole.

Molecular Properties

Compound Name11-propan-2-ylbenzo[a]carbazole
PubChem CID118058944
Molecular FormulaC19H17N
Molecular Weight259.35 g/mol
Exact Mass259.14
IUPAC Name11-propan-2-ylbenzo[a]carbazole
SMILESCC(C)n1c2ccccc2c2ccc3ccccc3c21
InChIInChI=1S/C19H17N/c1-13(2)20-18-10-6-5-9-16(18)17-12-11-14-7-3-4-8-15(14)19(17)20/h3-13H,1-2H3
InChIKeyUASNEYAOYKSGNU-UHFFFAOYSA-N
XLogP5.53
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500259.35
LogP ≤ 55.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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11-phenyl-9-propan-2-ylbenzo[a]carbazole
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18-propan-2-yl-5-oxa-18-azapentacyclo[9.7.0.02,8.04,6.012,17]octadeca-1(11),2(8),9,12,14,16-hexaene-3,7-dione
CID 155520337
12-methyl-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;12-methyl-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;11-methylbenzo[a]carbazole;5-methylbenzo[b]carbazole;9-methylcarbazole
CID 163692832
ethane;(2Z,4Z)-hexa-2,4-diene;9-propan-2-ylcarbazole
CID 165044718
4,27-diethyl-4,27-diazaheptacyclo[15.11.0.02,14.03,11.05,10.020,28.021,26]octacosa-1(17),2(14),3(11),5,7,9,12,15,18,20(28),21,23,25-tridecaene
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4-propan-2-ylthieno[3,2-b]indol-3-amine
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Frequently Asked Questions

What is the IUPAC name of 11-propan-2-ylbenzo[a]carbazole?
The IUPAC name of 11-propan-2-ylbenzo[a]carbazole (CID 118058944) is 11-propan-2-ylbenzo[a]carbazole.
What is the SMILES notation for 11-propan-2-ylbenzo[a]carbazole?
The canonical SMILES for 11-propan-2-ylbenzo[a]carbazole is CC(C)n1c2ccccc2c2ccc3ccccc3c21.
What is the InChIKey of 11-propan-2-ylbenzo[a]carbazole?
The InChIKey is UASNEYAOYKSGNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N/c1-13(2)20-18-10-6-5-9-16(18)17-12-11-14-7-3-4-8-15(14)19(17)20/h3-13H,1-2H3.
What are the key properties of 11-propan-2-ylbenzo[a]carbazole?
11-propan-2-ylbenzo[a]carbazole has a molecular weight of 259.35 g/mol, XLogP of 5.53, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 11-propan-2-ylbenzo[a]carbazole is sourced from PubChem (CID 118058944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).