ethane;5-ethoxy-9-ethylcarbazole-4-carboxamide

C21H30N2O2 — CID 91519432

IUPACethane;5-ethoxy-9-ethylcarbazole-4-carboxamide
SMILESCC.CC.CCOc1cccc2c1c1c(C(N)=O)cccc1n2CC
InChIInChI=1S/C17H18N2O2.2C2H6/c1-3-19-12-8-5-7-11(17(18)20)15(12)16-13(19)9-6-10-14(16)21-4-2;2*1-2/h5-10H,3-4H2,1-2H3,(H2,18,20);2*1-2H3
InChIKeyLFYDDCWXCCLHRZ-UHFFFAOYSA-N
MW342.48 g/mol
LogP5.36
Rot. Bonds4

About ethane;5-ethoxy-9-ethylcarbazole-4-carboxamide

ethane;5-ethoxy-9-ethylcarbazole-4-carboxamide (PubChem CID 91519432) has the molecular formula C21H30N2O2 and a molecular weight of 342.48 g/mol. Its IUPAC name is ethane;5-ethoxy-9-ethylcarbazole-4-carboxamide.

Molecular Properties

Compound Nameethane;5-ethoxy-9-ethylcarbazole-4-carboxamide
PubChem CID91519432
Molecular FormulaC21H30N2O2
Molecular Weight342.48 g/mol
Exact Mass342.23
IUPAC Nameethane;5-ethoxy-9-ethylcarbazole-4-carboxamide
SMILESCC.CC.CCOc1cccc2c1c1c(C(N)=O)cccc1n2CC
InChIInChI=1S/C17H18N2O2.2C2H6/c1-3-19-12-8-5-7-11(17(18)20)15(12)16-13(19)9-6-10-14(16)21-4-2;2*1-2/h5-10H,3-4H2,1-2H3,(H2,18,20);2*1-2H3
InChIKeyLFYDDCWXCCLHRZ-UHFFFAOYSA-N
XLogP5.36
TPSA57.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.48
LogP ≤ 55.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

9-ethyl-5-hydroxycarbazole-4-carboxamide
CID 59934183
9-ethyl-5-methylcarbazole-4-carboxamide
CID 59934194
ethyl 2-(9-benzyl-5-carbamoylcarbazol-4-yl)oxyacetate
CID 10135735
2-[5-carbamoyl-9-(cyclobutylmethyl)carbazol-4-yl]oxyacetic acid
CID 22741302
2-amino-3-ethoxybenzamide
CID 70121071
ethane;9-ethoxy-5-ethyl-3,4-dihydro-1H-thiopyrano[4,3-b]indole-1-carboxamide
CID 91024614
sodium 2-[5-carbamoyl-9-(cyclohexylmethyl)carbazol-4-yl]oxyacetate
CID 25034675
2-[5-carbamoyl-9-(1-ethylpyrrolidin-3-yl)carbazol-4-yl]oxyacetic acid
CID 22740495
sodium 2-[5-carbamoyl-9-[(3,5-dimethylphenyl)methyl]carbazol-4-yl]oxyacetate
CID 21304071
2-[5-carbamoyl-9-(3-phenylpropyl)carbazol-4-yl]oxyacetic acid
CID 22740410
methyl 2-[5-carbamoyl-9-(pyridin-2-ylmethyl)carbazol-4-yl]oxyacetate
CID 86756280
methyl 2-[5-carbamoyl-9-[(2,3-difluorophenyl)methyl]carbazol-4-yl]oxyacetate
CID 86756275

Frequently Asked Questions

What is the IUPAC name of ethane;5-ethoxy-9-ethylcarbazole-4-carboxamide?
The IUPAC name of ethane;5-ethoxy-9-ethylcarbazole-4-carboxamide (CID 91519432) is ethane;5-ethoxy-9-ethylcarbazole-4-carboxamide.
What is the SMILES notation for ethane;5-ethoxy-9-ethylcarbazole-4-carboxamide?
The canonical SMILES for ethane;5-ethoxy-9-ethylcarbazole-4-carboxamide is CC.CC.CCOc1cccc2c1c1c(C(N)=O)cccc1n2CC.
What is the InChIKey of ethane;5-ethoxy-9-ethylcarbazole-4-carboxamide?
The InChIKey is LFYDDCWXCCLHRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2.2C2H6/c1-3-19-12-8-5-7-11(17(18)20)15(12)16-13(19)9-6-10-14(16)21-4-2;2*1-2/h5-10H,3-4H2,1-2H3,(H2,18,20);2*1-2H3.
What are the key properties of ethane;5-ethoxy-9-ethylcarbazole-4-carboxamide?
ethane;5-ethoxy-9-ethylcarbazole-4-carboxamide has a molecular weight of 342.48 g/mol, XLogP of 5.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-ethoxy-9-ethylcarbazole-4-carboxamide is sourced from PubChem (CID 91519432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).