4,7-bis(1H-pyrazol-5-yl)-1,5-naphthyridin-2-amine

C14H11N7 — CID 154649469

IUPAC4,7-bis(1H-pyrazol-5-yl)-1,5-naphthyridin-2-amine
SMILESNc1cc(-c2ccn[nH]2)c2ncc(-c3ccn[nH]3)cc2n1
InChIInChI=1S/C14H11N7/c15-13-6-9(11-2-4-18-21-11)14-12(19-13)5-8(7-16-14)10-1-3-17-20-10/h1-7H,(H2,15,19)(H,17,20)(H,18,21)
InChIKeyURHVIRKAOPGAQK-UHFFFAOYSA-N
MW277.29 g/mol
LogP1.99
Rot. Bonds2

About 4,7-bis(1H-pyrazol-5-yl)-1,5-naphthyridin-2-amine

4,7-bis(1H-pyrazol-5-yl)-1,5-naphthyridin-2-amine (PubChem CID 154649469) has the molecular formula C14H11N7 and a molecular weight of 277.29 g/mol. Its IUPAC name is 4,7-bis(1H-pyrazol-5-yl)-1,5-naphthyridin-2-amine.

Molecular Properties

Compound Name4,7-bis(1H-pyrazol-5-yl)-1,5-naphthyridin-2-amine
PubChem CID154649469
Molecular FormulaC14H11N7
Molecular Weight277.29 g/mol
Exact Mass277.11
IUPAC Name4,7-bis(1H-pyrazol-5-yl)-1,5-naphthyridin-2-amine
SMILESNc1cc(-c2ccn[nH]2)c2ncc(-c3ccn[nH]3)cc2n1
InChIInChI=1S/C14H11N7/c15-13-6-9(11-2-4-18-21-11)14-12(19-13)5-8(7-16-14)10-1-3-17-20-10/h1-7H,(H2,15,19)(H,17,20)(H,18,21)
InChIKeyURHVIRKAOPGAQK-UHFFFAOYSA-N
XLogP1.99
TPSA109.16 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.29
LogP ≤ 51.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4,7-bis(1H-pyrazol-5-yl)-1,5-naphthyridin-2-amine?
The IUPAC name of 4,7-bis(1H-pyrazol-5-yl)-1,5-naphthyridin-2-amine (CID 154649469) is 4,7-bis(1H-pyrazol-5-yl)-1,5-naphthyridin-2-amine.
What is the SMILES notation for 4,7-bis(1H-pyrazol-5-yl)-1,5-naphthyridin-2-amine?
The canonical SMILES for 4,7-bis(1H-pyrazol-5-yl)-1,5-naphthyridin-2-amine is Nc1cc(-c2ccn[nH]2)c2ncc(-c3ccn[nH]3)cc2n1.
What is the InChIKey of 4,7-bis(1H-pyrazol-5-yl)-1,5-naphthyridin-2-amine?
The InChIKey is URHVIRKAOPGAQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N7/c15-13-6-9(11-2-4-18-21-11)14-12(19-13)5-8(7-16-14)10-1-3-17-20-10/h1-7H,(H2,15,19)(H,17,20)(H,18,21).
What are the key properties of 4,7-bis(1H-pyrazol-5-yl)-1,5-naphthyridin-2-amine?
4,7-bis(1H-pyrazol-5-yl)-1,5-naphthyridin-2-amine has a molecular weight of 277.29 g/mol, XLogP of 1.99, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-bis(1H-pyrazol-5-yl)-1,5-naphthyridin-2-amine is sourced from PubChem (CID 154649469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).