1-(7-bromo-1,5-naphthyridin-4-yl)-3-methylpiperidin-4-ol

C14H16BrN3O — CID 114680866

IUPAC1-(7-bromo-1,5-naphthyridin-4-yl)-3-methylpiperidin-4-ol
SMILESCC1CN(c2ccnc3cc(Br)cnc23)CCC1O
InChIInChI=1S/C14H16BrN3O/c1-9-8-18(5-3-13(9)19)12-2-4-16-11-6-10(15)7-17-14(11)12/h2,4,6-7,9,13,19H,3,5,8H2,1H3
InChIKeyGCIYAEITCSHYLA-UHFFFAOYSA-N
MW322.21 g/mol
LogP2.60
Rot. Bonds1

About 1-(7-bromo-1,5-naphthyridin-4-yl)-3-methylpiperidin-4-ol

1-(7-bromo-1,5-naphthyridin-4-yl)-3-methylpiperidin-4-ol (PubChem CID 114680866) has the molecular formula C14H16BrN3O and a molecular weight of 322.21 g/mol. Its IUPAC name is 1-(7-bromo-1,5-naphthyridin-4-yl)-3-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-(7-bromo-1,5-naphthyridin-4-yl)-3-methylpiperidin-4-ol
PubChem CID114680866
Molecular FormulaC14H16BrN3O
Molecular Weight322.21 g/mol
Exact Mass321.05
IUPAC Name1-(7-bromo-1,5-naphthyridin-4-yl)-3-methylpiperidin-4-ol
SMILESCC1CN(c2ccnc3cc(Br)cnc23)CCC1O
InChIInChI=1S/C14H16BrN3O/c1-9-8-18(5-3-13(9)19)12-2-4-16-11-6-10(15)7-17-14(11)12/h2,4,6-7,9,13,19H,3,5,8H2,1H3
InChIKeyGCIYAEITCSHYLA-UHFFFAOYSA-N
XLogP2.60
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.21
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-bromo-8-(3,4-dimethylpiperazin-1-yl)-1,5-naphthyridine
CID 113394506
1-(7-bromo-1,5-naphthyridin-4-yl)-N-methylpiperidine-3-carboxamide
CID 104530089
[1-(7-bromo-1,5-naphthyridin-4-yl)piperidin-4-yl]-pyrrolidin-1-ylmethanone
CID 133481700
1-(7-bromo-1,5-naphthyridin-4-yl)-N-ethylazetidine-3-carboxamide
CID 75509889
1-(7-bromo-1,5-naphthyridin-4-yl)-N-(3,5-dimethoxyphenyl)piperidin-4-amine
CID 133483896
1-[1-(7-bromo-1,5-naphthyridin-4-yl)piperidin-4-yl]pyrrolidin-2-one
CID 133482933
4-(7-bromo-1,5-naphthyridin-4-yl)-1,4-thiazepane
CID 113394491
1-(7-bromo-1,5-naphthyridin-4-yl)-N-ethyl-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 133483608
3-bromo-8-(4-phenyl-1,4-diazepan-1-yl)-1,5-naphthyridine
CID 133482284
4-(7-bromo-1,5-naphthyridin-4-yl)-2-(2-fluorophenyl)morpholine
CID 133482831
(2S)-1-[(2R)-1-(7-bromo-1,5-naphthyridin-4-yl)pyrrolidin-2-yl]propan-2-ol
CID 99705046
3-bromo-8-(4-pyridazin-3-ylpiperazin-1-yl)-1,5-naphthyridine
CID 133482708

Frequently Asked Questions

What is the IUPAC name of 1-(7-bromo-1,5-naphthyridin-4-yl)-3-methylpiperidin-4-ol?
The IUPAC name of 1-(7-bromo-1,5-naphthyridin-4-yl)-3-methylpiperidin-4-ol (CID 114680866) is 1-(7-bromo-1,5-naphthyridin-4-yl)-3-methylpiperidin-4-ol.
What is the SMILES notation for 1-(7-bromo-1,5-naphthyridin-4-yl)-3-methylpiperidin-4-ol?
The canonical SMILES for 1-(7-bromo-1,5-naphthyridin-4-yl)-3-methylpiperidin-4-ol is CC1CN(c2ccnc3cc(Br)cnc23)CCC1O.
What is the InChIKey of 1-(7-bromo-1,5-naphthyridin-4-yl)-3-methylpiperidin-4-ol?
The InChIKey is GCIYAEITCSHYLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16BrN3O/c1-9-8-18(5-3-13(9)19)12-2-4-16-11-6-10(15)7-17-14(11)12/h2,4,6-7,9,13,19H,3,5,8H2,1H3.
What are the key properties of 1-(7-bromo-1,5-naphthyridin-4-yl)-3-methylpiperidin-4-ol?
1-(7-bromo-1,5-naphthyridin-4-yl)-3-methylpiperidin-4-ol has a molecular weight of 322.21 g/mol, XLogP of 2.60, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-bromo-1,5-naphthyridin-4-yl)-3-methylpiperidin-4-ol is sourced from PubChem (CID 114680866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).