8-(oxan-4-yl)-6,7,8,9-tetrahydro-5H-carbazole-1,7-dicarboxamide

C19H23N3O3 — CID 66607024

IUPAC8-(oxan-4-yl)-6,7,8,9-tetrahydro-5H-carbazole-1,7-dicarboxamide
SMILESNC(=O)c1cccc2c3c([nH]c12)C(C1CCOCC1)C(C(N)=O)CC3
InChIInChI=1S/C19H23N3O3/c20-18(23)13-5-4-12-11-2-1-3-14(19(21)24)16(11)22-17(12)15(13)10-6-8-25-9-7-10/h1-3,10,13,15,22H,4-9H2,(H2,20,23)(H2,21,24)
InChIKeyKPAJZMWLDPUXGD-UHFFFAOYSA-N
MW341.41 g/mol
LogP1.82
Rot. Bonds3

About 8-(oxan-4-yl)-6,7,8,9-tetrahydro-5H-carbazole-1,7-dicarboxamide

8-(oxan-4-yl)-6,7,8,9-tetrahydro-5H-carbazole-1,7-dicarboxamide (PubChem CID 66607024) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 8-(oxan-4-yl)-6,7,8,9-tetrahydro-5H-carbazole-1,7-dicarboxamide.

Molecular Properties

Compound Name8-(oxan-4-yl)-6,7,8,9-tetrahydro-5H-carbazole-1,7-dicarboxamide
PubChem CID66607024
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name8-(oxan-4-yl)-6,7,8,9-tetrahydro-5H-carbazole-1,7-dicarboxamide
SMILESNC(=O)c1cccc2c3c([nH]c12)C(C1CCOCC1)C(C(N)=O)CC3
InChIInChI=1S/C19H23N3O3/c20-18(23)13-5-4-12-11-2-1-3-14(19(21)24)16(11)22-17(12)15(13)10-6-8-25-9-7-10/h1-3,10,13,15,22H,4-9H2,(H2,20,23)(H2,21,24)
InChIKeyKPAJZMWLDPUXGD-UHFFFAOYSA-N
XLogP1.82
TPSA111.20 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 51.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

8,8-dimethyl-5,6,7,9-tetrahydrocarbazole-1,7-dicarboxamide
CID 130362581
7-(2-hydroxypropan-2-yl)-6,7,8,9-tetrahydro-5H-carbazole-1-carboxamide
CID 154407267
3-amino-2-(oxan-4-yloxy)benzamide
CID 112579800
(1R)-1-amino-2,3-dihydro-1H-indene-4-carboxamide
CID 130682508
9H-carbazole-1-carboxamide;hydrochloride
CID 141272518
1-fluoro-2,3-dihydro-1H-indene-4-carboxamide
CID 135337152
2-amino-3-(oxolan-3-ylamino)benzamide
CID 115546663
3-amino-2-(oxan-4-ylmethylamino)benzamide
CID 112578986
(2S,3R)-7-oxa-8,18-diazatetracyclo[9.7.0.02,8.012,17]octadeca-1(11),12,14,16-tetraene-3-carboxamide
CID 10803060
3-amino-2-(oxan-4-yloxy)benzoic acid
CID 84699973
(2-aminophenyl)-(oxan-4-yl)methanone
CID 64834175
2-amino-1-(oxan-4-yl)pyrrole-3-carboxamide
CID 178068263

Frequently Asked Questions

What is the IUPAC name of 8-(oxan-4-yl)-6,7,8,9-tetrahydro-5H-carbazole-1,7-dicarboxamide?
The IUPAC name of 8-(oxan-4-yl)-6,7,8,9-tetrahydro-5H-carbazole-1,7-dicarboxamide (CID 66607024) is 8-(oxan-4-yl)-6,7,8,9-tetrahydro-5H-carbazole-1,7-dicarboxamide.
What is the SMILES notation for 8-(oxan-4-yl)-6,7,8,9-tetrahydro-5H-carbazole-1,7-dicarboxamide?
The canonical SMILES for 8-(oxan-4-yl)-6,7,8,9-tetrahydro-5H-carbazole-1,7-dicarboxamide is NC(=O)c1cccc2c3c([nH]c12)C(C1CCOCC1)C(C(N)=O)CC3.
What is the InChIKey of 8-(oxan-4-yl)-6,7,8,9-tetrahydro-5H-carbazole-1,7-dicarboxamide?
The InChIKey is KPAJZMWLDPUXGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c20-18(23)13-5-4-12-11-2-1-3-14(19(21)24)16(11)22-17(12)15(13)10-6-8-25-9-7-10/h1-3,10,13,15,22H,4-9H2,(H2,20,23)(H2,21,24).
What are the key properties of 8-(oxan-4-yl)-6,7,8,9-tetrahydro-5H-carbazole-1,7-dicarboxamide?
8-(oxan-4-yl)-6,7,8,9-tetrahydro-5H-carbazole-1,7-dicarboxamide has a molecular weight of 341.41 g/mol, XLogP of 1.82, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(oxan-4-yl)-6,7,8,9-tetrahydro-5H-carbazole-1,7-dicarboxamide is sourced from PubChem (CID 66607024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).