1-(3,6,7,8-tetrahydro-2H-cyclopenta[g]indol-1-yl)propan-2-amine

C14H20N2 — CID 23400516

IUPAC1-(3,6,7,8-tetrahydro-2H-cyclopenta[g]indol-1-yl)propan-2-amine
SMILESCC(N)CN1CCc2ccc3c(c21)CCC3
InChIInChI=1S/C14H20N2/c1-10(15)9-16-8-7-12-6-5-11-3-2-4-13(11)14(12)16/h5-6,10H,2-4,7-9,15H2,1H3
InChIKeySMZATIOUWJCUAG-UHFFFAOYSA-N
MW216.33 g/mol
LogP1.88
Rot. Bonds2

About 1-(3,6,7,8-tetrahydro-2H-cyclopenta[g]indol-1-yl)propan-2-amine

1-(3,6,7,8-tetrahydro-2H-cyclopenta[g]indol-1-yl)propan-2-amine (PubChem CID 23400516) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is 1-(3,6,7,8-tetrahydro-2H-cyclopenta[g]indol-1-yl)propan-2-amine.

Molecular Properties

Compound Name1-(3,6,7,8-tetrahydro-2H-cyclopenta[g]indol-1-yl)propan-2-amine
PubChem CID23400516
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name1-(3,6,7,8-tetrahydro-2H-cyclopenta[g]indol-1-yl)propan-2-amine
SMILESCC(N)CN1CCc2ccc3c(c21)CCC3
InChIInChI=1S/C14H20N2/c1-10(15)9-16-8-7-12-6-5-11-3-2-4-13(11)14(12)16/h5-6,10H,2-4,7-9,15H2,1H3
InChIKeySMZATIOUWJCUAG-UHFFFAOYSA-N
XLogP1.88
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3,6,7,8-tetrahydro-2H-cyclopenta[g]indol-1-yl)propan-2-amine?
The IUPAC name of 1-(3,6,7,8-tetrahydro-2H-cyclopenta[g]indol-1-yl)propan-2-amine (CID 23400516) is 1-(3,6,7,8-tetrahydro-2H-cyclopenta[g]indol-1-yl)propan-2-amine.
What is the SMILES notation for 1-(3,6,7,8-tetrahydro-2H-cyclopenta[g]indol-1-yl)propan-2-amine?
The canonical SMILES for 1-(3,6,7,8-tetrahydro-2H-cyclopenta[g]indol-1-yl)propan-2-amine is CC(N)CN1CCc2ccc3c(c21)CCC3.
What is the InChIKey of 1-(3,6,7,8-tetrahydro-2H-cyclopenta[g]indol-1-yl)propan-2-amine?
The InChIKey is SMZATIOUWJCUAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-10(15)9-16-8-7-12-6-5-11-3-2-4-13(11)14(12)16/h5-6,10H,2-4,7-9,15H2,1H3.
What are the key properties of 1-(3,6,7,8-tetrahydro-2H-cyclopenta[g]indol-1-yl)propan-2-amine?
1-(3,6,7,8-tetrahydro-2H-cyclopenta[g]indol-1-yl)propan-2-amine has a molecular weight of 216.33 g/mol, XLogP of 1.88, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,6,7,8-tetrahydro-2H-cyclopenta[g]indol-1-yl)propan-2-amine is sourced from PubChem (CID 23400516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).