N-(9H-carbazol-3-yl)-2-methylfuran-3-carboxamide

C18H14N2O2 — CID 43917235

IUPACN-(9H-carbazol-3-yl)-2-methylfuran-3-carboxamide
SMILESCc1occc1C(=O)Nc1ccc2[nH]c3ccccc3c2c1
InChIInChI=1S/C18H14N2O2/c1-11-13(8-9-22-11)18(21)19-12-6-7-17-15(10-12)14-4-2-3-5-16(14)20-17/h2-10,20H,1H3,(H,19,21)
InChIKeyXFXOPRZXVSGPDQ-UHFFFAOYSA-N
MW290.32 g/mol
LogP4.47
Rot. Bonds2

About N-(9H-carbazol-3-yl)-2-methylfuran-3-carboxamide

N-(9H-carbazol-3-yl)-2-methylfuran-3-carboxamide (PubChem CID 43917235) has the molecular formula C18H14N2O2 and a molecular weight of 290.32 g/mol. Its IUPAC name is N-(9H-carbazol-3-yl)-2-methylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(9H-carbazol-3-yl)-2-methylfuran-3-carboxamide
PubChem CID43917235
Molecular FormulaC18H14N2O2
Molecular Weight290.32 g/mol
Exact Mass290.11
IUPAC NameN-(9H-carbazol-3-yl)-2-methylfuran-3-carboxamide
SMILESCc1occc1C(=O)Nc1ccc2[nH]c3ccccc3c2c1
InChIInChI=1S/C18H14N2O2/c1-11-13(8-9-22-11)18(21)19-12-6-7-17-15(10-12)14-4-2-3-5-16(14)20-17/h2-10,20H,1H3,(H,19,21)
InChIKeyXFXOPRZXVSGPDQ-UHFFFAOYSA-N
XLogP4.47
TPSA58.03 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 54.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(9H-carbazol-3-yl)-2-methylfuran-3-carboxamide?
The IUPAC name of N-(9H-carbazol-3-yl)-2-methylfuran-3-carboxamide (CID 43917235) is N-(9H-carbazol-3-yl)-2-methylfuran-3-carboxamide.
What is the SMILES notation for N-(9H-carbazol-3-yl)-2-methylfuran-3-carboxamide?
The canonical SMILES for N-(9H-carbazol-3-yl)-2-methylfuran-3-carboxamide is Cc1occc1C(=O)Nc1ccc2[nH]c3ccccc3c2c1.
What is the InChIKey of N-(9H-carbazol-3-yl)-2-methylfuran-3-carboxamide?
The InChIKey is XFXOPRZXVSGPDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O2/c1-11-13(8-9-22-11)18(21)19-12-6-7-17-15(10-12)14-4-2-3-5-16(14)20-17/h2-10,20H,1H3,(H,19,21).
What are the key properties of N-(9H-carbazol-3-yl)-2-methylfuran-3-carboxamide?
N-(9H-carbazol-3-yl)-2-methylfuran-3-carboxamide has a molecular weight of 290.32 g/mol, XLogP of 4.47, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9H-carbazol-3-yl)-2-methylfuran-3-carboxamide is sourced from PubChem (CID 43917235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).