2-[(7-bromo-1,5-naphthyridin-4-yl)oxy]-N-methylcyclohexan-1-amine

C15H18BrN3O — CID 102634551

IUPAC2-[(7-bromo-1,5-naphthyridin-4-yl)oxy]-N-methylcyclohexan-1-amine
SMILESCNC1CCCCC1Oc1ccnc2cc(Br)cnc12
InChIInChI=1S/C15H18BrN3O/c1-17-11-4-2-3-5-13(11)20-14-6-7-18-12-8-10(16)9-19-15(12)14/h6-9,11,13,17H,2-5H2,1H3
InChIKeyZNSWFQIJDKSXPP-UHFFFAOYSA-N
MW336.23 g/mol
LogP3.30
Rot. Bonds3

About 2-[(7-bromo-1,5-naphthyridin-4-yl)oxy]-N-methylcyclohexan-1-amine

2-[(7-bromo-1,5-naphthyridin-4-yl)oxy]-N-methylcyclohexan-1-amine (PubChem CID 102634551) has the molecular formula C15H18BrN3O and a molecular weight of 336.23 g/mol. Its IUPAC name is 2-[(7-bromo-1,5-naphthyridin-4-yl)oxy]-N-methylcyclohexan-1-amine.

Molecular Properties

Compound Name2-[(7-bromo-1,5-naphthyridin-4-yl)oxy]-N-methylcyclohexan-1-amine
PubChem CID102634551
Molecular FormulaC15H18BrN3O
Molecular Weight336.23 g/mol
Exact Mass335.06
IUPAC Name2-[(7-bromo-1,5-naphthyridin-4-yl)oxy]-N-methylcyclohexan-1-amine
SMILESCNC1CCCCC1Oc1ccnc2cc(Br)cnc12
InChIInChI=1S/C15H18BrN3O/c1-17-11-4-2-3-5-13(11)20-14-6-7-18-12-8-10(16)9-19-15(12)14/h6-9,11,13,17H,2-5H2,1H3
InChIKeyZNSWFQIJDKSXPP-UHFFFAOYSA-N
XLogP3.30
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.23
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(3-bromo-4-pyridinyl)oxy]-N-methylcyclohexan-1-amine
CID 102634773
trans-(1R,2R)-2-N-(7-bromo-1,5-naphthyridin-4-yl)cyclohexane-1,2-diamine
CID 102738731
trans-(1S,2S)-2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol
CID 99777938
2-[(7-bromo-1,5-naphthyridin-4-yl)amino]cyclopentan-1-ol
CID 91648836
3-bromo-4-[2-(methylamino)cyclohexyl]oxybenzonitrile
CID 102634370
7-bromo-N-[2-(chloromethyl)cyclohexyl]-1,5-naphthyridin-4-amine
CID 106365685
N-methyl-2-quinolin-7-yloxycycloheptan-1-amine
CID 107313438
7-bromo-N-[2-(chloromethyl)cyclopentyl]-1,5-naphthyridin-4-amine
CID 106365510
3-bromo-8-[3-(2-methoxyethoxy)propoxy]-1,5-naphthyridine
CID 103404124
7-bromo-N-(2-pyrazol-1-ylcyclohexyl)-1,5-naphthyridin-4-amine
CID 133483777
3-bromo-8-[2-(3-methoxypropoxy)ethoxy]-1,5-naphthyridine
CID 103179363
2-[(7-bromo-1,5-naphthyridin-4-yl)-methylamino]cyclohexan-1-ol
CID 102635969

Frequently Asked Questions

What is the IUPAC name of 2-[(7-bromo-1,5-naphthyridin-4-yl)oxy]-N-methylcyclohexan-1-amine?
The IUPAC name of 2-[(7-bromo-1,5-naphthyridin-4-yl)oxy]-N-methylcyclohexan-1-amine (CID 102634551) is 2-[(7-bromo-1,5-naphthyridin-4-yl)oxy]-N-methylcyclohexan-1-amine.
What is the SMILES notation for 2-[(7-bromo-1,5-naphthyridin-4-yl)oxy]-N-methylcyclohexan-1-amine?
The canonical SMILES for 2-[(7-bromo-1,5-naphthyridin-4-yl)oxy]-N-methylcyclohexan-1-amine is CNC1CCCCC1Oc1ccnc2cc(Br)cnc12.
What is the InChIKey of 2-[(7-bromo-1,5-naphthyridin-4-yl)oxy]-N-methylcyclohexan-1-amine?
The InChIKey is ZNSWFQIJDKSXPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18BrN3O/c1-17-11-4-2-3-5-13(11)20-14-6-7-18-12-8-10(16)9-19-15(12)14/h6-9,11,13,17H,2-5H2,1H3.
What are the key properties of 2-[(7-bromo-1,5-naphthyridin-4-yl)oxy]-N-methylcyclohexan-1-amine?
2-[(7-bromo-1,5-naphthyridin-4-yl)oxy]-N-methylcyclohexan-1-amine has a molecular weight of 336.23 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 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)oxy]-N-methylcyclohexan-1-amine is sourced from PubChem (CID 102634551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).