4-(3-bromo-5-cyclohexyloxy-1,6-naphthyridin-7-yl)morpholine

C18H22BrN3O2 — CID 165113101

IUPAC4-(3-bromo-5-cyclohexyloxy-1,6-naphthyridin-7-yl)morpholine
SMILESBrc1cnc2cc(N3CCOCC3)nc(OC3CCCCC3)c2c1
InChIInChI=1S/C18H22BrN3O2/c19-13-10-15-16(20-12-13)11-17(22-6-8-23-9-7-22)21-18(15)24-14-4-2-1-3-5-14/h10-12,14H,1-9H2
InChIKeyTVKVLLFYOWPVJO-UHFFFAOYSA-N
MW392.30 g/mol
LogP3.94
Rot. Bonds3

About 4-(3-bromo-5-cyclohexyloxy-1,6-naphthyridin-7-yl)morpholine

4-(3-bromo-5-cyclohexyloxy-1,6-naphthyridin-7-yl)morpholine (PubChem CID 165113101) has the molecular formula C18H22BrN3O2 and a molecular weight of 392.30 g/mol. Its IUPAC name is 4-(3-bromo-5-cyclohexyloxy-1,6-naphthyridin-7-yl)morpholine.

Molecular Properties

Compound Name4-(3-bromo-5-cyclohexyloxy-1,6-naphthyridin-7-yl)morpholine
PubChem CID165113101
Molecular FormulaC18H22BrN3O2
Molecular Weight392.30 g/mol
Exact Mass391.09
IUPAC Name4-(3-bromo-5-cyclohexyloxy-1,6-naphthyridin-7-yl)morpholine
SMILESBrc1cnc2cc(N3CCOCC3)nc(OC3CCCCC3)c2c1
InChIInChI=1S/C18H22BrN3O2/c19-13-10-15-16(20-12-13)11-17(22-6-8-23-9-7-22)21-18(15)24-14-4-2-1-3-5-14/h10-12,14H,1-9H2
InChIKeyTVKVLLFYOWPVJO-UHFFFAOYSA-N
XLogP3.94
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.30
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-(5-bromo-2-cyclohexyloxy-3-pyridinyl)morpholine
CID 167395778
5-[4-[(5-bromopyrimidin-2-yl)amino]cyclohexyl]oxy-7-morpholin-4-yl-1,6-naphthyridin-3-amine
CID 165113640
5-iodo-N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]pyrimidin-2-amine
CID 165113010
4-[5-(4-pyrrol-1-ylcyclohexyl)oxy-3-(2H-tetrazol-5-yl)-1,6-naphthyridin-7-yl]morpholine
CID 175633196
N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]pyridazin-3-amine
CID 165113093
2-[2-[[4-[(3-methyl-7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]amino]pyrimidin-5-yl]oxyacetic acid
CID 175633179
N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]pyridine-3-carboxamide
CID 165112973
5-chloro-N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]pyrimidine-2-carboxamide
CID 165112805
N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]-5-propoxypyrimidin-2-amine
CID 165113223
4-[5-(4-imidazol-1-ylcyclohexyl)oxy-7-morpholin-4-yl-1,6-naphthyridin-3-yl]-2-methylbut-3-yn-2-ol
CID 165113562
2-[2-[[4-[(3-iodo-7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]amino]pyrimidin-5-yl]oxy-N,N-dimethylacetamide
CID 165113573
[7-morpholin-4-yl-5-[4-[[5-(2-morpholin-4-ylethoxy)pyrimidin-2-yl]amino]cyclohexyl]oxy-1,6-naphthyridin-3-yl]methanesulfonamide
CID 175781293

Frequently Asked Questions

What is the IUPAC name of 4-(3-bromo-5-cyclohexyloxy-1,6-naphthyridin-7-yl)morpholine?
The IUPAC name of 4-(3-bromo-5-cyclohexyloxy-1,6-naphthyridin-7-yl)morpholine (CID 165113101) is 4-(3-bromo-5-cyclohexyloxy-1,6-naphthyridin-7-yl)morpholine.
What is the SMILES notation for 4-(3-bromo-5-cyclohexyloxy-1,6-naphthyridin-7-yl)morpholine?
The canonical SMILES for 4-(3-bromo-5-cyclohexyloxy-1,6-naphthyridin-7-yl)morpholine is Brc1cnc2cc(N3CCOCC3)nc(OC3CCCCC3)c2c1.
What is the InChIKey of 4-(3-bromo-5-cyclohexyloxy-1,6-naphthyridin-7-yl)morpholine?
The InChIKey is TVKVLLFYOWPVJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22BrN3O2/c19-13-10-15-16(20-12-13)11-17(22-6-8-23-9-7-22)21-18(15)24-14-4-2-1-3-5-14/h10-12,14H,1-9H2.
What are the key properties of 4-(3-bromo-5-cyclohexyloxy-1,6-naphthyridin-7-yl)morpholine?
4-(3-bromo-5-cyclohexyloxy-1,6-naphthyridin-7-yl)morpholine has a molecular weight of 392.30 g/mol, XLogP of 3.94, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-bromo-5-cyclohexyloxy-1,6-naphthyridin-7-yl)morpholine is sourced from PubChem (CID 165113101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).