9-ethyl-5-methylcarbazole-4-carboxamide

C16H16N2O — CID 59934194

IUPAC9-ethyl-5-methylcarbazole-4-carboxamide
SMILESCCn1c2cccc(C)c2c2c(C(N)=O)cccc21
InChIInChI=1S/C16H16N2O/c1-3-18-12-8-4-6-10(2)14(12)15-11(16(17)19)7-5-9-13(15)18/h4-9H,3H2,1-2H3,(H2,17,19)
InChIKeySXQUBVXKXWWEQQ-UHFFFAOYSA-N
MW252.32 g/mol
LogP3.22
Rot. Bonds2

About 9-ethyl-5-methylcarbazole-4-carboxamide

9-ethyl-5-methylcarbazole-4-carboxamide (PubChem CID 59934194) has the molecular formula C16H16N2O and a molecular weight of 252.32 g/mol. Its IUPAC name is 9-ethyl-5-methylcarbazole-4-carboxamide.

Molecular Properties

Compound Name9-ethyl-5-methylcarbazole-4-carboxamide
PubChem CID59934194
Molecular FormulaC16H16N2O
Molecular Weight252.32 g/mol
Exact Mass252.13
IUPAC Name9-ethyl-5-methylcarbazole-4-carboxamide
SMILESCCn1c2cccc(C)c2c2c(C(N)=O)cccc21
InChIInChI=1S/C16H16N2O/c1-3-18-12-8-4-6-10(2)14(12)15-11(16(17)19)7-5-9-13(15)18/h4-9H,3H2,1-2H3,(H2,17,19)
InChIKeySXQUBVXKXWWEQQ-UHFFFAOYSA-N
XLogP3.22
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-ethyl-5-methylcarbazole-4-carboxamide?
The IUPAC name of 9-ethyl-5-methylcarbazole-4-carboxamide (CID 59934194) is 9-ethyl-5-methylcarbazole-4-carboxamide.
What is the SMILES notation for 9-ethyl-5-methylcarbazole-4-carboxamide?
The canonical SMILES for 9-ethyl-5-methylcarbazole-4-carboxamide is CCn1c2cccc(C)c2c2c(C(N)=O)cccc21.
What is the InChIKey of 9-ethyl-5-methylcarbazole-4-carboxamide?
The InChIKey is SXQUBVXKXWWEQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O/c1-3-18-12-8-4-6-10(2)14(12)15-11(16(17)19)7-5-9-13(15)18/h4-9H,3H2,1-2H3,(H2,17,19).
What are the key properties of 9-ethyl-5-methylcarbazole-4-carboxamide?
9-ethyl-5-methylcarbazole-4-carboxamide has a molecular weight of 252.32 g/mol, XLogP of 3.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-5-methylcarbazole-4-carboxamide is sourced from PubChem (CID 59934194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).