2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)propan-1-ol

C11H16N2O — CID 102772845

IUPAC2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)propan-1-ol
SMILESCC(CO)NC1CCc2cccnc21
InChIInChI=1S/C11H16N2O/c1-8(7-14)13-10-5-4-9-3-2-6-12-11(9)10/h2-3,6,8,10,13-14H,4-5,7H2,1H3
InChIKeyATRZZEONJAXFKH-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.04
Rot. Bonds3

About 2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)propan-1-ol

2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)propan-1-ol (PubChem CID 102772845) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)propan-1-ol.

Molecular Properties

Compound Name2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)propan-1-ol
PubChem CID102772845
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)propan-1-ol
SMILESCC(CO)NC1CCc2cccnc21
InChIInChI=1S/C11H16N2O/c1-8(7-14)13-10-5-4-9-3-2-6-12-11(9)10/h2-3,6,8,10,13-14H,4-5,7H2,1H3
InChIKeyATRZZEONJAXFKH-UHFFFAOYSA-N
XLogP1.04
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)propan-1-ol?
The IUPAC name of 2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)propan-1-ol (CID 102772845) is 2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)propan-1-ol.
What is the SMILES notation for 2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)propan-1-ol?
The canonical SMILES for 2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)propan-1-ol is CC(CO)NC1CCc2cccnc21.
What is the InChIKey of 2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)propan-1-ol?
The InChIKey is ATRZZEONJAXFKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-8(7-14)13-10-5-4-9-3-2-6-12-11(9)10/h2-3,6,8,10,13-14H,4-5,7H2,1H3.
What are the key properties of 2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)propan-1-ol?
2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)propan-1-ol has a molecular weight of 192.26 g/mol, XLogP of 1.04, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)propan-1-ol is sourced from PubChem (CID 102772845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).