1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-methylbutan-1-amine

C13H20N2 — CID 79748029

IUPAC1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-methylbutan-1-amine
SMILESCC(C)CC(N)C1CCc2cccnc21
InChIInChI=1S/C13H20N2/c1-9(2)8-12(14)11-6-5-10-4-3-7-15-13(10)11/h3-4,7,9,11-12H,5-6,8,14H2,1-2H3
InChIKeyGZUCODVJMOEQAU-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.48
Rot. Bonds3

About 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-methylbutan-1-amine

1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-methylbutan-1-amine (PubChem CID 79748029) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-methylbutan-1-amine.

Molecular Properties

Compound Name1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-methylbutan-1-amine
PubChem CID79748029
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-methylbutan-1-amine
SMILESCC(C)CC(N)C1CCc2cccnc21
InChIInChI=1S/C13H20N2/c1-9(2)8-12(14)11-6-5-10-4-3-7-15-13(10)11/h3-4,7,9,11-12H,5-6,8,14H2,1-2H3
InChIKeyGZUCODVJMOEQAU-UHFFFAOYSA-N
XLogP2.48
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)butan-1-amine
CID 79748418
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-methoxyethanamine
CID 79747968
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-ethoxyethanamine
CID 79747927
2-(4-bromophenyl)-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)ethanamine
CID 79748660
1-(5,6,7,8-tetrahydroquinolin-8-yl)butan-1-amine
CID 79748417
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-propylpentan-1-amine
CID 105009869
[1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-methylpentyl]hydrazine
CID 105322059
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(2,2-dimethylcyclopropyl)methanamine
CID 107004734
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(2-methylphenyl)methanamine
CID 79748906
cyclooctyl(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanamine
CID 80604020
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(1-methylcyclohexyl)methanamine
CID 106830346
4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-methylpentan-2-amine
CID 79738392

Frequently Asked Questions

What is the IUPAC name of 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-methylbutan-1-amine?
The IUPAC name of 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-methylbutan-1-amine (CID 79748029) is 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-methylbutan-1-amine.
What is the SMILES notation for 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-methylbutan-1-amine?
The canonical SMILES for 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-methylbutan-1-amine is CC(C)CC(N)C1CCc2cccnc21.
What is the InChIKey of 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-methylbutan-1-amine?
The InChIKey is GZUCODVJMOEQAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-9(2)8-12(14)11-6-5-10-4-3-7-15-13(10)11/h3-4,7,9,11-12H,5-6,8,14H2,1-2H3.
What are the key properties of 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-methylbutan-1-amine?
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-methylbutan-1-amine has a molecular weight of 204.32 g/mol, XLogP of 2.48, 3 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)-3-methylbutan-1-amine is sourced from PubChem (CID 79748029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).