3-pyridin-3-yl-1,5-naphthyridine-2,7-diamine

C13H11N5 — CID 174929269

IUPAC3-pyridin-3-yl-1,5-naphthyridine-2,7-diamine
SMILESNc1cnc2cc(-c3cccnc3)c(N)nc2c1
InChIInChI=1S/C13H11N5/c14-9-4-12-11(17-7-9)5-10(13(15)18-12)8-2-1-3-16-6-8/h1-7H,14H2,(H2,15,18)
InChIKeyPRPKIKCRLFFRNO-UHFFFAOYSA-N
MW237.27 g/mol
LogP1.86
Rot. Bonds1

About 3-pyridin-3-yl-1,5-naphthyridine-2,7-diamine

3-pyridin-3-yl-1,5-naphthyridine-2,7-diamine (PubChem CID 174929269) has the molecular formula C13H11N5 and a molecular weight of 237.27 g/mol. Its IUPAC name is 3-pyridin-3-yl-1,5-naphthyridine-2,7-diamine.

Molecular Properties

Compound Name3-pyridin-3-yl-1,5-naphthyridine-2,7-diamine
PubChem CID174929269
Molecular FormulaC13H11N5
Molecular Weight237.27 g/mol
Exact Mass237.10
IUPAC Name3-pyridin-3-yl-1,5-naphthyridine-2,7-diamine
SMILESNc1cnc2cc(-c3cccnc3)c(N)nc2c1
InChIInChI=1S/C13H11N5/c14-9-4-12-11(17-7-9)5-10(13(15)18-12)8-2-1-3-16-6-8/h1-7H,14H2,(H2,15,18)
InChIKeyPRPKIKCRLFFRNO-UHFFFAOYSA-N
XLogP1.86
TPSA90.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.27
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-pyridin-3-yl-1,5-naphthyridine-2,7-diamine?
The IUPAC name of 3-pyridin-3-yl-1,5-naphthyridine-2,7-diamine (CID 174929269) is 3-pyridin-3-yl-1,5-naphthyridine-2,7-diamine.
What is the SMILES notation for 3-pyridin-3-yl-1,5-naphthyridine-2,7-diamine?
The canonical SMILES for 3-pyridin-3-yl-1,5-naphthyridine-2,7-diamine is Nc1cnc2cc(-c3cccnc3)c(N)nc2c1.
What is the InChIKey of 3-pyridin-3-yl-1,5-naphthyridine-2,7-diamine?
The InChIKey is PRPKIKCRLFFRNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N5/c14-9-4-12-11(17-7-9)5-10(13(15)18-12)8-2-1-3-16-6-8/h1-7H,14H2,(H2,15,18).
What are the key properties of 3-pyridin-3-yl-1,5-naphthyridine-2,7-diamine?
3-pyridin-3-yl-1,5-naphthyridine-2,7-diamine has a molecular weight of 237.27 g/mol, XLogP of 1.86, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyridin-3-yl-1,5-naphthyridine-2,7-diamine is sourced from PubChem (CID 174929269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).