N-[5-(2-aminopyrimidin-5-yl)-3-pyridinyl]naphthalene-2-sulfonamide

C19H15N5O2S — CID 57399592

IUPACN-[5-(2-aminopyrimidin-5-yl)-3-pyridinyl]naphthalene-2-sulfonamide
SMILESNc1ncc(-c2cncc(NS(=O)(=O)c3ccc4ccccc4c3)c2)cn1
InChIInChI=1S/C19H15N5O2S/c20-19-22-10-16(11-23-19)15-7-17(12-21-9-15)24-27(25,26)18-6-5-13-3-1-2-4-14(13)8-18/h1-12,24H,(H2,20,22,23)
InChIKeyCUIZRUBEOONHNU-UHFFFAOYSA-N
MW377.43 g/mol
LogP3.07
Rot. Bonds4

About N-[5-(2-aminopyrimidin-5-yl)-3-pyridinyl]naphthalene-2-sulfonamide

N-[5-(2-aminopyrimidin-5-yl)-3-pyridinyl]naphthalene-2-sulfonamide (PubChem CID 57399592) has the molecular formula C19H15N5O2S and a molecular weight of 377.43 g/mol. Its IUPAC name is N-[5-(2-aminopyrimidin-5-yl)-3-pyridinyl]naphthalene-2-sulfonamide.

Molecular Properties

Compound NameN-[5-(2-aminopyrimidin-5-yl)-3-pyridinyl]naphthalene-2-sulfonamide
PubChem CID57399592
Molecular FormulaC19H15N5O2S
Molecular Weight377.43 g/mol
Exact Mass377.09
IUPAC NameN-[5-(2-aminopyrimidin-5-yl)-3-pyridinyl]naphthalene-2-sulfonamide
SMILESNc1ncc(-c2cncc(NS(=O)(=O)c3ccc4ccccc4c3)c2)cn1
InChIInChI=1S/C19H15N5O2S/c20-19-22-10-16(11-23-19)15-7-17(12-21-9-15)24-27(25,26)18-6-5-13-3-1-2-4-14(13)8-18/h1-12,24H,(H2,20,22,23)
InChIKeyCUIZRUBEOONHNU-UHFFFAOYSA-N
XLogP3.07
TPSA110.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.43
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[5-(2-aminopyrimidin-5-yl)-3-pyridinyl]naphthalene-2-sulfonamide?
The IUPAC name of N-[5-(2-aminopyrimidin-5-yl)-3-pyridinyl]naphthalene-2-sulfonamide (CID 57399592) is N-[5-(2-aminopyrimidin-5-yl)-3-pyridinyl]naphthalene-2-sulfonamide.
What is the SMILES notation for N-[5-(2-aminopyrimidin-5-yl)-3-pyridinyl]naphthalene-2-sulfonamide?
The canonical SMILES for N-[5-(2-aminopyrimidin-5-yl)-3-pyridinyl]naphthalene-2-sulfonamide is Nc1ncc(-c2cncc(NS(=O)(=O)c3ccc4ccccc4c3)c2)cn1.
What is the InChIKey of N-[5-(2-aminopyrimidin-5-yl)-3-pyridinyl]naphthalene-2-sulfonamide?
The InChIKey is CUIZRUBEOONHNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5O2S/c20-19-22-10-16(11-23-19)15-7-17(12-21-9-15)24-27(25,26)18-6-5-13-3-1-2-4-14(13)8-18/h1-12,24H,(H2,20,22,23).
What are the key properties of N-[5-(2-aminopyrimidin-5-yl)-3-pyridinyl]naphthalene-2-sulfonamide?
N-[5-(2-aminopyrimidin-5-yl)-3-pyridinyl]naphthalene-2-sulfonamide has a molecular weight of 377.43 g/mol, XLogP of 3.07, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2-aminopyrimidin-5-yl)-3-pyridinyl]naphthalene-2-sulfonamide is sourced from PubChem (CID 57399592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).