4-bromo-N,N-dimethyl-7-pyrimidin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-1-amine

C14H16BrN5 — CID 138009070

IUPAC4-bromo-N,N-dimethyl-7-pyrimidin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-1-amine
SMILESCN(C)c1ncc(Br)c2c1CN(c1ncccn1)CC2
InChIInChI=1S/C14H16BrN5/c1-19(2)13-11-9-20(14-16-5-3-6-17-14)7-4-10(11)12(15)8-18-13/h3,5-6,8H,4,7,9H2,1-2H3
InChIKeyOLJSASJVWIOUMO-UHFFFAOYSA-N
MW334.22 g/mol
LogP2.26
Rot. Bonds2

About 4-bromo-N,N-dimethyl-7-pyrimidin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-1-amine

4-bromo-N,N-dimethyl-7-pyrimidin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-1-amine (PubChem CID 138009070) has the molecular formula C14H16BrN5 and a molecular weight of 334.22 g/mol. Its IUPAC name is 4-bromo-N,N-dimethyl-7-pyrimidin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-1-amine.

Molecular Properties

Compound Name4-bromo-N,N-dimethyl-7-pyrimidin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-1-amine
PubChem CID138009070
Molecular FormulaC14H16BrN5
Molecular Weight334.22 g/mol
Exact Mass333.06
IUPAC Name4-bromo-N,N-dimethyl-7-pyrimidin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-1-amine
SMILESCN(C)c1ncc(Br)c2c1CN(c1ncccn1)CC2
InChIInChI=1S/C14H16BrN5/c1-19(2)13-11-9-20(14-16-5-3-6-17-14)7-4-10(11)12(15)8-18-13/h3,5-6,8H,4,7,9H2,1-2H3
InChIKeyOLJSASJVWIOUMO-UHFFFAOYSA-N
XLogP2.26
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.22
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-bromo-N,N-dimethyl-7-pyrimidin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-1-amine?
The IUPAC name of 4-bromo-N,N-dimethyl-7-pyrimidin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-1-amine (CID 138009070) is 4-bromo-N,N-dimethyl-7-pyrimidin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-1-amine.
What is the SMILES notation for 4-bromo-N,N-dimethyl-7-pyrimidin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-1-amine?
The canonical SMILES for 4-bromo-N,N-dimethyl-7-pyrimidin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-1-amine is CN(C)c1ncc(Br)c2c1CN(c1ncccn1)CC2.
What is the InChIKey of 4-bromo-N,N-dimethyl-7-pyrimidin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-1-amine?
The InChIKey is OLJSASJVWIOUMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16BrN5/c1-19(2)13-11-9-20(14-16-5-3-6-17-14)7-4-10(11)12(15)8-18-13/h3,5-6,8H,4,7,9H2,1-2H3.
What are the key properties of 4-bromo-N,N-dimethyl-7-pyrimidin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-1-amine?
4-bromo-N,N-dimethyl-7-pyrimidin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-1-amine has a molecular weight of 334.22 g/mol, XLogP of 2.26, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N,N-dimethyl-7-pyrimidin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-1-amine is sourced from PubChem (CID 138009070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).