ethyl 6-morpholin-4-yl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylate

C19H24N2O3 — CID 11652799

IUPACethyl 6-morpholin-4-yl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylate
SMILESCCOC(=O)C1CCCc2c1[nH]c1ccc(N3CCOCC3)cc21
InChIInChI=1S/C19H24N2O3/c1-2-24-19(22)15-5-3-4-14-16-12-13(21-8-10-23-11-9-21)6-7-17(16)20-18(14)15/h6-7,12,15,20H,2-5,8-11H2,1H3
InChIKeyCCHYCCGJEFDJQJ-UHFFFAOYSA-N
MW328.41 g/mol
LogP2.99
Rot. Bonds3

About ethyl 6-morpholin-4-yl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylate

ethyl 6-morpholin-4-yl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylate (PubChem CID 11652799) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is ethyl 6-morpholin-4-yl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylate.

Molecular Properties

Compound Nameethyl 6-morpholin-4-yl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylate
PubChem CID11652799
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Nameethyl 6-morpholin-4-yl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylate
SMILESCCOC(=O)C1CCCc2c1[nH]c1ccc(N3CCOCC3)cc21
InChIInChI=1S/C19H24N2O3/c1-2-24-19(22)15-5-3-4-14-16-12-13(21-8-10-23-11-9-21)6-7-17(16)20-18(14)15/h6-7,12,15,20H,2-5,8-11H2,1H3
InChIKeyCCHYCCGJEFDJQJ-UHFFFAOYSA-N
XLogP2.99
TPSA54.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 98375
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CID 4555562
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CID 5315744
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CID 736464
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CID 21598349
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CID 145879
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CID 6426909
CID 6426909

Frequently Asked Questions

What is the IUPAC name of ethyl 6-morpholin-4-yl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylate?
The IUPAC name of ethyl 6-morpholin-4-yl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylate (CID 11652799) is ethyl 6-morpholin-4-yl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylate.
What is the SMILES notation for ethyl 6-morpholin-4-yl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylate?
The canonical SMILES for ethyl 6-morpholin-4-yl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylate is CCOC(=O)C1CCCc2c1[nH]c1ccc(N3CCOCC3)cc21.
What is the InChIKey of ethyl 6-morpholin-4-yl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylate?
The InChIKey is CCHYCCGJEFDJQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-2-24-19(22)15-5-3-4-14-16-12-13(21-8-10-23-11-9-21)6-7-17(16)20-18(14)15/h6-7,12,15,20H,2-5,8-11H2,1H3.
What are the key properties of ethyl 6-morpholin-4-yl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylate?
ethyl 6-morpholin-4-yl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylate has a molecular weight of 328.41 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 6-morpholin-4-yl-2,3,4,9-tetrahydro-1H-carbazole-1-carboxylate is sourced from PubChem (CID 11652799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).