9-butyl-3-methoxycarbazole

C17H19NO — CID 132503458

IUPAC9-butyl-3-methoxycarbazole
SMILESCCCCn1c2ccccc2c2cc(OC)ccc21
InChIInChI=1S/C17H19NO/c1-3-4-11-18-16-8-6-5-7-14(16)15-12-13(19-2)9-10-17(15)18/h5-10,12H,3-4,11H2,1-2H3
InChIKeyNKAPNFVJJHAPJR-UHFFFAOYSA-N
MW253.35 g/mol
LogP4.60
Rot. Bonds4

About 9-butyl-3-methoxycarbazole

9-butyl-3-methoxycarbazole (PubChem CID 132503458) has the molecular formula C17H19NO and a molecular weight of 253.35 g/mol. Its IUPAC name is 9-butyl-3-methoxycarbazole.

Molecular Properties

Compound Name9-butyl-3-methoxycarbazole
PubChem CID132503458
Molecular FormulaC17H19NO
Molecular Weight253.35 g/mol
Exact Mass253.15
IUPAC Name9-butyl-3-methoxycarbazole
SMILESCCCCn1c2ccccc2c2cc(OC)ccc21
InChIInChI=1S/C17H19NO/c1-3-4-11-18-16-8-6-5-7-14(16)15-12-13(19-2)9-10-17(15)18/h5-10,12H,3-4,11H2,1-2H3
InChIKeyNKAPNFVJJHAPJR-UHFFFAOYSA-N
XLogP4.60
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-methoxycarbazol-9-yl)propan-1-amine
CID 153297207
5-(3-methoxycarbazol-9-yl)pentan-1-ol
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9-butylcarbazol-3-ol
CID 140908966
9-hexadecylcarbazole
CID 4166588
9-docosylcarbazole
CID 10528568
1-(3-methoxycarbazol-9-yl)pentan-1-one
CID 153297253
benzene;9-octylcarbazole
CID 175067369
3-butyl-5-methoxy-1,2-dimethylindole
CID 129194050
9-butyl-6-methoxy-3-phenylpyrano[3,4-b]indol-1-one
CID 56679903
2-octoxy-9-octylcarbazole
CID 15163804
9-octadecyl-2-octoxycarbazole
CID 15163807
2-dodecoxy-9-dodecylcarbazole
CID 15163810

Frequently Asked Questions

What is the IUPAC name of 9-butyl-3-methoxycarbazole?
The IUPAC name of 9-butyl-3-methoxycarbazole (CID 132503458) is 9-butyl-3-methoxycarbazole.
What is the SMILES notation for 9-butyl-3-methoxycarbazole?
The canonical SMILES for 9-butyl-3-methoxycarbazole is CCCCn1c2ccccc2c2cc(OC)ccc21.
What is the InChIKey of 9-butyl-3-methoxycarbazole?
The InChIKey is NKAPNFVJJHAPJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO/c1-3-4-11-18-16-8-6-5-7-14(16)15-12-13(19-2)9-10-17(15)18/h5-10,12H,3-4,11H2,1-2H3.
What are the key properties of 9-butyl-3-methoxycarbazole?
9-butyl-3-methoxycarbazole has a molecular weight of 253.35 g/mol, XLogP of 4.60, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-butyl-3-methoxycarbazole is sourced from PubChem (CID 132503458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).