6-(methylamino)-6,7,8,9-tetrahydro-5H-carbazole-4-carboxamide

C14H17N3O — CID 171382229

IUPAC6-(methylamino)-6,7,8,9-tetrahydro-5H-carbazole-4-carboxamide
SMILESCNC1CCc2[nH]c3cccc(C(N)=O)c3c2C1
InChIInChI=1S/C14H17N3O/c1-16-8-5-6-11-10(7-8)13-9(14(15)18)3-2-4-12(13)17-11/h2-4,8,16-17H,5-7H2,1H3,(H2,15,18)
InChIKeyHQQZYGMUCRYWSS-UHFFFAOYSA-N
MW243.31 g/mol
LogP1.34
Rot. Bonds2

About 6-(methylamino)-6,7,8,9-tetrahydro-5H-carbazole-4-carboxamide

6-(methylamino)-6,7,8,9-tetrahydro-5H-carbazole-4-carboxamide (PubChem CID 171382229) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is 6-(methylamino)-6,7,8,9-tetrahydro-5H-carbazole-4-carboxamide.

Molecular Properties

Compound Name6-(methylamino)-6,7,8,9-tetrahydro-5H-carbazole-4-carboxamide
PubChem CID171382229
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name6-(methylamino)-6,7,8,9-tetrahydro-5H-carbazole-4-carboxamide
SMILESCNC1CCc2[nH]c3cccc(C(N)=O)c3c2C1
InChIInChI=1S/C14H17N3O/c1-16-8-5-6-11-10(7-8)13-9(14(15)18)3-2-4-12(13)17-11/h2-4,8,16-17H,5-7H2,1H3,(H2,15,18)
InChIKeyHQQZYGMUCRYWSS-UHFFFAOYSA-N
XLogP1.34
TPSA70.91 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 51.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(methylamino)-6,7,8,9-tetrahydro-5H-carbazole-4-carboxamide?
The IUPAC name of 6-(methylamino)-6,7,8,9-tetrahydro-5H-carbazole-4-carboxamide (CID 171382229) is 6-(methylamino)-6,7,8,9-tetrahydro-5H-carbazole-4-carboxamide.
What is the SMILES notation for 6-(methylamino)-6,7,8,9-tetrahydro-5H-carbazole-4-carboxamide?
The canonical SMILES for 6-(methylamino)-6,7,8,9-tetrahydro-5H-carbazole-4-carboxamide is CNC1CCc2[nH]c3cccc(C(N)=O)c3c2C1.
What is the InChIKey of 6-(methylamino)-6,7,8,9-tetrahydro-5H-carbazole-4-carboxamide?
The InChIKey is HQQZYGMUCRYWSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-16-8-5-6-11-10(7-8)13-9(14(15)18)3-2-4-12(13)17-11/h2-4,8,16-17H,5-7H2,1H3,(H2,15,18).
What are the key properties of 6-(methylamino)-6,7,8,9-tetrahydro-5H-carbazole-4-carboxamide?
6-(methylamino)-6,7,8,9-tetrahydro-5H-carbazole-4-carboxamide has a molecular weight of 243.31 g/mol, XLogP of 1.34, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methylamino)-6,7,8,9-tetrahydro-5H-carbazole-4-carboxamide is sourced from PubChem (CID 171382229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).