1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-ethylpentan-1-amine

C15H24N2 — CID 79747782

IUPAC1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-ethylpentan-1-amine
SMILESCCCCC(NCC)C1CCc2cccnc21
InChIInChI=1S/C15H24N2/c1-3-5-8-14(16-4-2)13-10-9-12-7-6-11-17-15(12)13/h6-7,11,13-14,16H,3-5,8-10H2,1-2H3
InChIKeyIOQIKTPZTGONBN-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.28
Rot. Bonds6

About 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-ethylpentan-1-amine

1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-ethylpentan-1-amine (PubChem CID 79747782) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-ethylpentan-1-amine.

Molecular Properties

Compound Name1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-ethylpentan-1-amine
PubChem CID79747782
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-ethylpentan-1-amine
SMILESCCCCC(NCC)C1CCc2cccnc21
InChIInChI=1S/C15H24N2/c1-3-5-8-14(16-4-2)13-10-9-12-7-6-11-17-15(12)13/h6-7,11,13-14,16H,3-5,8-10H2,1-2H3
InChIKeyIOQIKTPZTGONBN-UHFFFAOYSA-N
XLogP3.28
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-ethylpentan-1-amine?
The IUPAC name of 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-ethylpentan-1-amine (CID 79747782) is 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-ethylpentan-1-amine.
What is the SMILES notation for 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-ethylpentan-1-amine?
The canonical SMILES for 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-ethylpentan-1-amine is CCCCC(NCC)C1CCc2cccnc21.
What is the InChIKey of 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-ethylpentan-1-amine?
The InChIKey is IOQIKTPZTGONBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-3-5-8-14(16-4-2)13-10-9-12-7-6-11-17-15(12)13/h6-7,11,13-14,16H,3-5,8-10H2,1-2H3.
What are the key properties of 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-ethylpentan-1-amine?
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-ethylpentan-1-amine has a molecular weight of 232.37 g/mol, XLogP of 3.28, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-ethylpentan-1-amine is sourced from PubChem (CID 79747782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).