N-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-ylmethyl)ethanamine

C11H16N2 — CID 130164614

IUPACN-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-ylmethyl)ethanamine
SMILESCCNCc1ccc2c(n1)CCC2
InChIInChI=1S/C11H16N2/c1-2-12-8-10-7-6-9-4-3-5-11(9)13-10/h6-7,12H,2-5,8H2,1H3
InChIKeyZFADKFLJUZJIHQ-UHFFFAOYSA-N
MW176.26 g/mol
LogP1.68
Rot. Bonds3

About N-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-ylmethyl)ethanamine

N-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-ylmethyl)ethanamine (PubChem CID 130164614) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is N-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-ylmethyl)ethanamine
PubChem CID130164614
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC NameN-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-ylmethyl)ethanamine
SMILESCCNCc1ccc2c(n1)CCC2
InChIInChI=1S/C11H16N2/c1-2-12-8-10-7-6-9-4-3-5-11(9)13-10/h6-7,12H,2-5,8H2,1H3
InChIKeyZFADKFLJUZJIHQ-UHFFFAOYSA-N
XLogP1.68
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-ylmethyl)ethanamine?
The IUPAC name of N-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-ylmethyl)ethanamine (CID 130164614) is N-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-ylmethyl)ethanamine.
What is the SMILES notation for N-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-ylmethyl)ethanamine?
The canonical SMILES for N-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-ylmethyl)ethanamine is CCNCc1ccc2c(n1)CCC2.
What is the InChIKey of N-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-ylmethyl)ethanamine?
The InChIKey is ZFADKFLJUZJIHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2/c1-2-12-8-10-7-6-9-4-3-5-11(9)13-10/h6-7,12H,2-5,8H2,1H3.
What are the key properties of N-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-ylmethyl)ethanamine?
N-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-ylmethyl)ethanamine has a molecular weight of 176.26 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6,7-dihydro-5H-cyclopenta[b]pyridin-2-ylmethyl)ethanamine is sourced from PubChem (CID 130164614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).