6,9-dimethyl-1,2,3,4-tetrahydrocarbazol-4-amine

C14H18N2 — CID 84740019

IUPAC6,9-dimethyl-1,2,3,4-tetrahydrocarbazol-4-amine
SMILESCc1ccc2c(c1)c1c(n2C)CCCC1N
InChIInChI=1S/C14H18N2/c1-9-6-7-12-10(8-9)14-11(15)4-3-5-13(14)16(12)2/h6-8,11H,3-5,15H2,1-2H3
InChIKeyJMYOISZGAYPBTC-UHFFFAOYSA-N
MW214.31 g/mol
LogP2.82
Rot. Bonds

About 6,9-dimethyl-1,2,3,4-tetrahydrocarbazol-4-amine

6,9-dimethyl-1,2,3,4-tetrahydrocarbazol-4-amine (PubChem CID 84740019) has the molecular formula C14H18N2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 6,9-dimethyl-1,2,3,4-tetrahydrocarbazol-4-amine.

Molecular Properties

Compound Name6,9-dimethyl-1,2,3,4-tetrahydrocarbazol-4-amine
PubChem CID84740019
Molecular FormulaC14H18N2
Molecular Weight214.31 g/mol
Exact Mass214.15
IUPAC Name6,9-dimethyl-1,2,3,4-tetrahydrocarbazol-4-amine
SMILESCc1ccc2c(c1)c1c(n2C)CCCC1N
InChIInChI=1S/C14H18N2/c1-9-6-7-12-10(8-9)14-11(15)4-3-5-13(14)16(12)2/h6-8,11H,3-5,15H2,1-2H3
InChIKeyJMYOISZGAYPBTC-UHFFFAOYSA-N
XLogP2.82
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6,9-dimethyl-1,2,3,4-tetrahydrocarbazol-4-amine?
The IUPAC name of 6,9-dimethyl-1,2,3,4-tetrahydrocarbazol-4-amine (CID 84740019) is 6,9-dimethyl-1,2,3,4-tetrahydrocarbazol-4-amine.
What is the SMILES notation for 6,9-dimethyl-1,2,3,4-tetrahydrocarbazol-4-amine?
The canonical SMILES for 6,9-dimethyl-1,2,3,4-tetrahydrocarbazol-4-amine is Cc1ccc2c(c1)c1c(n2C)CCCC1N.
What is the InChIKey of 6,9-dimethyl-1,2,3,4-tetrahydrocarbazol-4-amine?
The InChIKey is JMYOISZGAYPBTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2/c1-9-6-7-12-10(8-9)14-11(15)4-3-5-13(14)16(12)2/h6-8,11H,3-5,15H2,1-2H3.
What are the key properties of 6,9-dimethyl-1,2,3,4-tetrahydrocarbazol-4-amine?
6,9-dimethyl-1,2,3,4-tetrahydrocarbazol-4-amine has a molecular weight of 214.31 g/mol, XLogP of 2.82, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,9-dimethyl-1,2,3,4-tetrahydrocarbazol-4-amine is sourced from PubChem (CID 84740019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).