5-pyrimidin-5-yl-1,6-naphthyridine

C12H8N4 — CID 163315592

IUPAC5-pyrimidin-5-yl-1,6-naphthyridine
SMILESc1cnc2ccnc(-c3cncnc3)c2c1
InChIInChI=1S/C12H8N4/c1-2-10-11(15-4-1)3-5-16-12(10)9-6-13-8-14-7-9/h1-8H
InChIKeyRKSRHGDDGXFVPK-UHFFFAOYSA-N
MW208.22 g/mol
LogP2.09
Rot. Bonds1

About 5-pyrimidin-5-yl-1,6-naphthyridine

5-pyrimidin-5-yl-1,6-naphthyridine (PubChem CID 163315592) has the molecular formula C12H8N4 and a molecular weight of 208.22 g/mol. Its IUPAC name is 5-pyrimidin-5-yl-1,6-naphthyridine.

Molecular Properties

Compound Name5-pyrimidin-5-yl-1,6-naphthyridine
PubChem CID163315592
Molecular FormulaC12H8N4
Molecular Weight208.22 g/mol
Exact Mass208.07
IUPAC Name5-pyrimidin-5-yl-1,6-naphthyridine
SMILESc1cnc2ccnc(-c3cncnc3)c2c1
InChIInChI=1S/C12H8N4/c1-2-10-11(15-4-1)3-5-16-12(10)9-6-13-8-14-7-9/h1-8H
InChIKeyRKSRHGDDGXFVPK-UHFFFAOYSA-N
XLogP2.09
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-(3-fluoro-5-methylphenyl)-1,6-naphthyridine
CID 162637917
1-pyrimidin-5-yl-9H-pyrido[3,4-b]indole
CID 175790323
2-pyrimidin-5-ylfuro[3,2-b]pyridine
CID 119090842
5-(2,3-difluorophenyl)-1,6-naphthyridine
CID 163316334
4-(1,6-naphthyridin-5-yl)-N-(2-pyridin-3-ylethyl)benzamide
CID 162631073
N,N-dimethyl-2-(1,6-naphthyridin-5-yl)aniline
CID 162638366
pyrrolo[3,4-d][1]benzazepine
CID 70490498
5-[2-(trifluoromethyl)-3-pyridinyl]pyrimidine
CID 170449159
pyrrolo[2,3-i][2,4]benzodiazepine
CID 172654038
5-methoxy-1,6-naphthyridine
CID 67055577
pyrido[2,3-h][1,4]benzoxazin-2-one
CID 141055478
5-(4-fluoro-2-methoxyphenyl)-1,6-naphthyridine
CID 162630412

Frequently Asked Questions

What is the IUPAC name of 5-pyrimidin-5-yl-1,6-naphthyridine?
The IUPAC name of 5-pyrimidin-5-yl-1,6-naphthyridine (CID 163315592) is 5-pyrimidin-5-yl-1,6-naphthyridine.
What is the SMILES notation for 5-pyrimidin-5-yl-1,6-naphthyridine?
The canonical SMILES for 5-pyrimidin-5-yl-1,6-naphthyridine is c1cnc2ccnc(-c3cncnc3)c2c1.
What is the InChIKey of 5-pyrimidin-5-yl-1,6-naphthyridine?
The InChIKey is RKSRHGDDGXFVPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8N4/c1-2-10-11(15-4-1)3-5-16-12(10)9-6-13-8-14-7-9/h1-8H.
What are the key properties of 5-pyrimidin-5-yl-1,6-naphthyridine?
5-pyrimidin-5-yl-1,6-naphthyridine has a molecular weight of 208.22 g/mol, XLogP of 2.09, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyrimidin-5-yl-1,6-naphthyridine is sourced from PubChem (CID 163315592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).