9-methyl-6,7,8,9-tetrahydropyrido[1,2-a]indole

C13H15N — CID 15287247

IUPAC9-methyl-6,7,8,9-tetrahydropyrido[1,2-a]indole
SMILESCC1CCCn2c1cc1ccccc12
InChIInChI=1S/C13H15N/c1-10-5-4-8-14-12-7-3-2-6-11(12)9-13(10)14/h2-3,6-7,9-10H,4-5,8H2,1H3
InChIKeyWZBCBJMSOXECQN-UHFFFAOYSA-N
MW185.27 g/mol
LogP3.54
Rot. Bonds

About 9-methyl-6,7,8,9-tetrahydropyrido[1,2-a]indole

9-methyl-6,7,8,9-tetrahydropyrido[1,2-a]indole (PubChem CID 15287247) has the molecular formula C13H15N and a molecular weight of 185.27 g/mol. Its IUPAC name is 9-methyl-6,7,8,9-tetrahydropyrido[1,2-a]indole.

Molecular Properties

Compound Name9-methyl-6,7,8,9-tetrahydropyrido[1,2-a]indole
PubChem CID15287247
Molecular FormulaC13H15N
Molecular Weight185.27 g/mol
Exact Mass185.12
IUPAC Name9-methyl-6,7,8,9-tetrahydropyrido[1,2-a]indole
SMILESCC1CCCn2c1cc1ccccc12
InChIInChI=1S/C13H15N/c1-10-5-4-8-14-12-7-3-2-6-11(12)9-13(10)14/h2-3,6-7,9-10H,4-5,8H2,1H3
InChIKeyWZBCBJMSOXECQN-UHFFFAOYSA-N
XLogP3.54
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-6,7,8,9-tetrahydropyrido[1,2-a]indole?
The IUPAC name of 9-methyl-6,7,8,9-tetrahydropyrido[1,2-a]indole (CID 15287247) is 9-methyl-6,7,8,9-tetrahydropyrido[1,2-a]indole.
What is the SMILES notation for 9-methyl-6,7,8,9-tetrahydropyrido[1,2-a]indole?
The canonical SMILES for 9-methyl-6,7,8,9-tetrahydropyrido[1,2-a]indole is CC1CCCn2c1cc1ccccc12.
What is the InChIKey of 9-methyl-6,7,8,9-tetrahydropyrido[1,2-a]indole?
The InChIKey is WZBCBJMSOXECQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N/c1-10-5-4-8-14-12-7-3-2-6-11(12)9-13(10)14/h2-3,6-7,9-10H,4-5,8H2,1H3.
What are the key properties of 9-methyl-6,7,8,9-tetrahydropyrido[1,2-a]indole?
9-methyl-6,7,8,9-tetrahydropyrido[1,2-a]indole has a molecular weight of 185.27 g/mol, XLogP of 3.54, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-6,7,8,9-tetrahydropyrido[1,2-a]indole is sourced from PubChem (CID 15287247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).