6-cyclopropyl-1,2,3,4-tetrahydroquinoline

C12H15N — CID 23004951

IUPAC6-cyclopropyl-1,2,3,4-tetrahydroquinoline
SMILESc1cc2c(cc1C1CC1)CCCN2
InChIInChI=1S/C12H15N/c1-2-11-8-10(9-3-4-9)5-6-12(11)13-7-1/h5-6,8-9,13H,1-4,7H2
InChIKeyHWQMHOYYWJFSAD-UHFFFAOYSA-N
MW173.26 g/mol
LogP2.92
Rot. Bonds1

About 6-cyclopropyl-1,2,3,4-tetrahydroquinoline

6-cyclopropyl-1,2,3,4-tetrahydroquinoline (PubChem CID 23004951) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is 6-cyclopropyl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name6-cyclopropyl-1,2,3,4-tetrahydroquinoline
PubChem CID23004951
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC Name6-cyclopropyl-1,2,3,4-tetrahydroquinoline
SMILESc1cc2c(cc1C1CC1)CCCN2
InChIInChI=1S/C12H15N/c1-2-11-8-10(9-3-4-9)5-6-12(11)13-7-1/h5-6,8-9,13H,1-4,7H2
InChIKeyHWQMHOYYWJFSAD-UHFFFAOYSA-N
XLogP2.92
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 6-cyclopropyl-1,2,3,4-tetrahydroquinoline (CID 23004951) is 6-cyclopropyl-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 6-cyclopropyl-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 6-cyclopropyl-1,2,3,4-tetrahydroquinoline is c1cc2c(cc1C1CC1)CCCN2.
What is the InChIKey of 6-cyclopropyl-1,2,3,4-tetrahydroquinoline?
The InChIKey is HWQMHOYYWJFSAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N/c1-2-11-8-10(9-3-4-9)5-6-12(11)13-7-1/h5-6,8-9,13H,1-4,7H2.
What are the key properties of 6-cyclopropyl-1,2,3,4-tetrahydroquinoline?
6-cyclopropyl-1,2,3,4-tetrahydroquinoline has a molecular weight of 173.26 g/mol, XLogP of 2.92, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 23004951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).