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

C15H19BrN4O — CID 116646580

IUPAC7-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-1,5-naphthyridin-4-amine
SMILESCCN1CCOC(CNc2ccnc3cc(Br)cnc23)C1
InChIInChI=1S/C15H19BrN4O/c1-2-20-5-6-21-12(10-20)9-18-13-3-4-17-14-7-11(16)8-19-15(13)14/h3-4,7-8,12H,2,5-6,9-10H2,1H3,(H,17,18)
InChIKeyDYAIFRRGKYNWFV-UHFFFAOYSA-N
MW351.25 g/mol
LogP2.52
Rot. Bonds4

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

7-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-1,5-naphthyridin-4-amine (PubChem CID 116646580) has the molecular formula C15H19BrN4O and a molecular weight of 351.25 g/mol. Its IUPAC name is 7-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-1,5-naphthyridin-4-amine.

Molecular Properties

Compound Name7-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-1,5-naphthyridin-4-amine
PubChem CID116646580
Molecular FormulaC15H19BrN4O
Molecular Weight351.25 g/mol
Exact Mass350.07
IUPAC Name7-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-1,5-naphthyridin-4-amine
SMILESCCN1CCOC(CNc2ccnc3cc(Br)cnc23)C1
InChIInChI=1S/C15H19BrN4O/c1-2-20-5-6-21-12(10-20)9-18-13-3-4-17-14-7-11(16)8-19-15(13)14/h3-4,7-8,12H,2,5-6,9-10H2,1H3,(H,17,18)
InChIKeyDYAIFRRGKYNWFV-UHFFFAOYSA-N
XLogP2.52
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.25
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-3-methylpyridin-2-amine
CID 115693777
N-[(4-ethylmorpholin-2-yl)methyl]quinolin-4-amine
CID 115620947
5-bromo-2-[(4-ethylmorpholin-2-yl)methylamino]pyridine-3-carboxylic acid
CID 114400346
4-N-[(4-ethylmorpholin-2-yl)methyl]pyridine-3,4-diamine
CID 114399235
5-chloro-N-[(4-ethylmorpholin-2-yl)methyl]quinolin-8-amine
CID 116784042
N-[(4-ethylmorpholin-2-yl)methyl]pyridin-4-amine
CID 114400660
7-bromo-N-[(2-methylcyclopentyl)methyl]-1,5-naphthyridin-4-amine
CID 107419345
4-N-[(4-ethylmorpholin-2-yl)methyl]pyrimidine-2,4-diamine
CID 114401447
N-[(4-ethylmorpholin-2-yl)methyl]-5-iodopyrimidin-2-amine
CID 113459925
5-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-2-hydrazinylpyridine-3-carboxamide
CID 114401197
4-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-3-methylaniline
CID 79165325
4-N-[(4-ethylmorpholin-2-yl)methyl]-2-N,2-N-dimethylpyrimidine-2,4-diamine
CID 115643858

Frequently Asked Questions

What is the IUPAC name of 7-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-1,5-naphthyridin-4-amine?
The IUPAC name of 7-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-1,5-naphthyridin-4-amine (CID 116646580) is 7-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-1,5-naphthyridin-4-amine.
What is the SMILES notation for 7-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-1,5-naphthyridin-4-amine?
The canonical SMILES for 7-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-1,5-naphthyridin-4-amine is CCN1CCOC(CNc2ccnc3cc(Br)cnc23)C1.
What is the InChIKey of 7-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-1,5-naphthyridin-4-amine?
The InChIKey is DYAIFRRGKYNWFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19BrN4O/c1-2-20-5-6-21-12(10-20)9-18-13-3-4-17-14-7-11(16)8-19-15(13)14/h3-4,7-8,12H,2,5-6,9-10H2,1H3,(H,17,18).
What are the key properties of 7-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-1,5-naphthyridin-4-amine?
7-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-1,5-naphthyridin-4-amine has a molecular weight of 351.25 g/mol, XLogP of 2.52, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-N-[(4-ethylmorpholin-2-yl)methyl]-1,5-naphthyridin-4-amine is sourced from PubChem (CID 116646580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).