5,6,7-trimethyl-N-propan-2-yl-2,3,4,9-tetrahydro-1H-carbazol-1-amine

C18H26N2 — CID 159520402

About 5,6,7-trimethyl-N-propan-2-yl-2,3,4,9-tetrahydro-1H-carbazol-1-amine

5,6,7-trimethyl-N-propan-2-yl-2,3,4,9-tetrahydro-1H-carbazol-1-amine (PubChem CID 159520402) has the molecular formula C18H26N2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 5,6,7-trimethyl-N-propan-2-yl-2,3,4,9-tetrahydro-1H-carbazol-1-amine.

Molecular Properties

• Compound Name: 5,6,7-trimethyl-N-propan-2-yl-2,3,4,9-tetrahydro-1H-carbazol-1-amine
• PubChem CID: 159520402
• Molecular Formula: C18H26N2
• Molecular Weight: 270.42 g/mol
• Exact Mass: 270.21
• IUPAC Name: 5,6,7-trimethyl-N-propan-2-yl-2,3,4,9-tetrahydro-1H-carbazol-1-amine
• SMILES: Cc1cc2[nH]c3c(c2c(C)c1C)CCCC3NC(C)C
• InChI: InChI=1S/C18H26N2/c1-10(2)19-15-8-6-7-14-17-13(5)12(4)11(3)9-16(17)20-18(14)15/h9-10,15,19-20H,6-8H2,1-5H3
• InChIKey: VCMSTRZTVSGDAP-UHFFFAOYSA-N
• XLogP: 4.47
• TPSA: 27.82 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 1
• Rotatable Bonds: 2
• Heavy Atoms: 20
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	270.42
LogP ≤ 5	4.47
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	1

Frequently Asked Questions

What is the IUPAC name of 5,6,7-trimethyl-N-propan-2-yl-2,3,4,9-tetrahydro-1H-carbazol-1-amine?

The IUPAC name of 5,6,7-trimethyl-N-propan-2-yl-2,3,4,9-tetrahydro-1H-carbazol-1-amine (CID 159520402) is 5,6,7-trimethyl-N-propan-2-yl-2,3,4,9-tetrahydro-1H-carbazol-1-amine.

What is the SMILES notation for 5,6,7-trimethyl-N-propan-2-yl-2,3,4,9-tetrahydro-1H-carbazol-1-amine?

The canonical SMILES for 5,6,7-trimethyl-N-propan-2-yl-2,3,4,9-tetrahydro-1H-carbazol-1-amine is Cc1cc2[nH]c3c(c2c(C)c1C)CCCC3NC(C)C.

What is the InChIKey of 5,6,7-trimethyl-N-propan-2-yl-2,3,4,9-tetrahydro-1H-carbazol-1-amine?

The InChIKey is VCMSTRZTVSGDAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2/c1-10(2)19-15-8-6-7-14-17-13(5)12(4)11(3)9-16(17)20-18(14)15/h9-10,15,19-20H,6-8H2,1-5H3.

What are the key properties of 5,6,7-trimethyl-N-propan-2-yl-2,3,4,9-tetrahydro-1H-carbazol-1-amine?

5,6,7-trimethyl-N-propan-2-yl-2,3,4,9-tetrahydro-1H-carbazol-1-amine has a molecular weight of 270.42 g/mol, XLogP of 4.47, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for 5,6,7-trimethyl-N-propan-2-yl-2,3,4,9-tetrahydro-1H-carbazol-1-amine is sourced from PubChem (CID 159520402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).