[5-[5-(1-aminocyclopropyl)-2-pyridinyl]-2-pyridinyl]methanol

C14H15N3O — CID 91592418

IUPAC[5-[5-(1-aminocyclopropyl)-2-pyridinyl]-2-pyridinyl]methanol
SMILESNC1(c2ccc(-c3ccc(CO)nc3)nc2)CC1
InChIInChI=1S/C14H15N3O/c15-14(5-6-14)11-2-4-13(17-8-11)10-1-3-12(9-18)16-7-10/h1-4,7-8,18H,5-6,9,15H2
InChIKeyOQFMOQOBYWJYAJ-UHFFFAOYSA-N
MW241.29 g/mol
LogP1.58
Rot. Bonds3

About [5-[5-(1-aminocyclopropyl)-2-pyridinyl]-2-pyridinyl]methanol

[5-[5-(1-aminocyclopropyl)-2-pyridinyl]-2-pyridinyl]methanol (PubChem CID 91592418) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is [5-[5-(1-aminocyclopropyl)-2-pyridinyl]-2-pyridinyl]methanol.

Molecular Properties

Compound Name[5-[5-(1-aminocyclopropyl)-2-pyridinyl]-2-pyridinyl]methanol
PubChem CID91592418
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name[5-[5-(1-aminocyclopropyl)-2-pyridinyl]-2-pyridinyl]methanol
SMILESNC1(c2ccc(-c3ccc(CO)nc3)nc2)CC1
InChIInChI=1S/C14H15N3O/c15-14(5-6-14)11-2-4-13(17-8-11)10-1-3-12(9-18)16-7-10/h1-4,7-8,18H,5-6,9,15H2
InChIKeyOQFMOQOBYWJYAJ-UHFFFAOYSA-N
XLogP1.58
TPSA72.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [5-[5-(1-aminocyclopropyl)-2-pyridinyl]-2-pyridinyl]methanol?
The IUPAC name of [5-[5-(1-aminocyclopropyl)-2-pyridinyl]-2-pyridinyl]methanol (CID 91592418) is [5-[5-(1-aminocyclopropyl)-2-pyridinyl]-2-pyridinyl]methanol.
What is the SMILES notation for [5-[5-(1-aminocyclopropyl)-2-pyridinyl]-2-pyridinyl]methanol?
The canonical SMILES for [5-[5-(1-aminocyclopropyl)-2-pyridinyl]-2-pyridinyl]methanol is NC1(c2ccc(-c3ccc(CO)nc3)nc2)CC1.
What is the InChIKey of [5-[5-(1-aminocyclopropyl)-2-pyridinyl]-2-pyridinyl]methanol?
The InChIKey is OQFMOQOBYWJYAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c15-14(5-6-14)11-2-4-13(17-8-11)10-1-3-12(9-18)16-7-10/h1-4,7-8,18H,5-6,9,15H2.
What are the key properties of [5-[5-(1-aminocyclopropyl)-2-pyridinyl]-2-pyridinyl]methanol?
[5-[5-(1-aminocyclopropyl)-2-pyridinyl]-2-pyridinyl]methanol has a molecular weight of 241.29 g/mol, XLogP of 1.58, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[5-(1-aminocyclopropyl)-2-pyridinyl]-2-pyridinyl]methanol is sourced from PubChem (CID 91592418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).