2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol

C13H14BrN3O — CID 91648836

IUPAC2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol
SMILESOC1CCCC1Nc1ccnc2cc(Br)cnc12
InChIInChI=1S/C13H14BrN3O/c14-8-6-11-13(16-7-8)10(4-5-15-11)17-9-2-1-3-12(9)18/h4-7,9,12,18H,1-3H2,(H,15,17)
InChIKeyLFFMEEODXNQWKQ-UHFFFAOYSA-N
MW308.18 g/mol
LogP2.72
Rot. Bonds2

About 2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol

2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol (PubChem CID 91648836) has the molecular formula C13H14BrN3O and a molecular weight of 308.18 g/mol. Its IUPAC name is 2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol
PubChem CID91648836
Molecular FormulaC13H14BrN3O
Molecular Weight308.18 g/mol
Exact Mass307.03
IUPAC Name2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol
SMILESOC1CCCC1Nc1ccnc2cc(Br)cnc12
InChIInChI=1S/C13H14BrN3O/c14-8-6-11-13(16-7-8)10(4-5-15-11)17-9-2-1-3-12(9)18/h4-7,9,12,18H,1-3H2,(H,15,17)
InChIKeyLFFMEEODXNQWKQ-UHFFFAOYSA-N
XLogP2.72
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.18
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

trans-(1S,2S)-2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol
CID 99777938
7-bromo-N-[2-(chloromethyl)cyclopentyl]-1,5-naphthyridin-4-amine
CID 106365510
trans-(1R,2R)-2-N-(7-bromo-1,5-naphthyridin-4-yl)cyclohexane-1,2-diamine
CID 102738731
7-bromo-N-[2-(chloromethyl)cyclohexyl]-1,5-naphthyridin-4-amine
CID 106365685
7-bromo-N-(2-pyrazol-1-ylcyclohexyl)-1,5-naphthyridin-4-amine
CID 133483777
7-bromo-N-[(2-methylcyclopentyl)methyl]-1,5-naphthyridin-4-amine
CID 107419345
2-[(7-bromo-1,5-naphthyridin-4-yl)amino]-N-cyclopropylacetamide
CID 113394394
7-bromo-N-(1,4-dioxaspiro[4.5]decan-8-yl)-1,5-naphthyridin-4-amine
CID 133482136
4-[(7-bromo-1,5-naphthyridin-4-yl)amino]pyrrolidin-2-one
CID 105023349
7-bromo-N-(pyrrolidin-2-ylmethyl)-1,5-naphthyridin-4-amine
CID 113394440
7-bromo-N-(3-methoxy-2,2-dimethylcyclobutyl)-1,5-naphthyridin-4-amine
CID 104891810
trans-(1S,2S)-2-[(6-chloroquinolin-4-yl)amino]cyclohexan-1-ol
CID 133495334

Frequently Asked Questions

What is the IUPAC name of 2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol?
The IUPAC name of 2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol (CID 91648836) is 2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol.
What is the SMILES notation for 2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol?
The canonical SMILES for 2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol is OC1CCCC1Nc1ccnc2cc(Br)cnc12.
What is the InChIKey of 2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol?
The InChIKey is LFFMEEODXNQWKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14BrN3O/c14-8-6-11-13(16-7-8)10(4-5-15-11)17-9-2-1-3-12(9)18/h4-7,9,12,18H,1-3H2,(H,15,17).
What are the key properties of 2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol?
2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol has a molecular weight of 308.18 g/mol, XLogP of 2.72, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol is sourced from PubChem (CID 91648836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).