[(1R,2R)-2-(1,5-naphthyridin-2-yl)cyclopropyl]methanol

C12H12N2O — CID 66836942

IUPAC[(1R,2R)-2-(1,5-naphthyridin-2-yl)cyclopropyl]methanol
SMILESOC[C@@H]1C[C@H]1c1ccc2ncccc2n1
InChIInChI=1S/C12H12N2O/c15-7-8-6-9(8)10-3-4-11-12(14-10)2-1-5-13-11/h1-5,8-9,15H,6-7H2/t8-,9+/m0/s1
InChIKeyUIYXGIUTGHATCV-DTWKUNHWSA-N
MW200.24 g/mol
LogP1.73
Rot. Bonds2

About [(1R,2R)-2-(1,5-naphthyridin-2-yl)cyclopropyl]methanol

[(1R,2R)-2-(1,5-naphthyridin-2-yl)cyclopropyl]methanol (PubChem CID 66836942) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is [(1R,2R)-2-(1,5-naphthyridin-2-yl)cyclopropyl]methanol.

Molecular Properties

Compound Name[(1R,2R)-2-(1,5-naphthyridin-2-yl)cyclopropyl]methanol
PubChem CID66836942
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC Name[(1R,2R)-2-(1,5-naphthyridin-2-yl)cyclopropyl]methanol
SMILESOC[C@@H]1C[C@H]1c1ccc2ncccc2n1
InChIInChI=1S/C12H12N2O/c15-7-8-6-9(8)10-3-4-11-12(14-10)2-1-5-13-11/h1-5,8-9,15H,6-7H2/t8-,9+/m0/s1
InChIKeyUIYXGIUTGHATCV-DTWKUNHWSA-N
XLogP1.73
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(1R,2R)-2-(1,5-naphthyridin-2-yl)cyclopropyl]methanol?
The IUPAC name of [(1R,2R)-2-(1,5-naphthyridin-2-yl)cyclopropyl]methanol (CID 66836942) is [(1R,2R)-2-(1,5-naphthyridin-2-yl)cyclopropyl]methanol.
What is the SMILES notation for [(1R,2R)-2-(1,5-naphthyridin-2-yl)cyclopropyl]methanol?
The canonical SMILES for [(1R,2R)-2-(1,5-naphthyridin-2-yl)cyclopropyl]methanol is OC[C@@H]1C[C@H]1c1ccc2ncccc2n1.
What is the InChIKey of [(1R,2R)-2-(1,5-naphthyridin-2-yl)cyclopropyl]methanol?
The InChIKey is UIYXGIUTGHATCV-DTWKUNHWSA-N. The full InChI is InChI=1S/C12H12N2O/c15-7-8-6-9(8)10-3-4-11-12(14-10)2-1-5-13-11/h1-5,8-9,15H,6-7H2/t8-,9+/m0/s1.
What are the key properties of [(1R,2R)-2-(1,5-naphthyridin-2-yl)cyclopropyl]methanol?
[(1R,2R)-2-(1,5-naphthyridin-2-yl)cyclopropyl]methanol has a molecular weight of 200.24 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2R)-2-(1,5-naphthyridin-2-yl)cyclopropyl]methanol is sourced from PubChem (CID 66836942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).