N-hydroxy-7-(pyridin-2-ylamino)-5,6,7,8-tetrahydronaphthalene-2-carboxamide

C16H17N3O2 — CID 56932650

IUPACN-hydroxy-7-(pyridin-2-ylamino)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
SMILESO=C(NO)c1ccc2c(c1)CC(Nc1ccccn1)CC2
InChIInChI=1S/C16H17N3O2/c20-16(19-21)12-5-4-11-6-7-14(10-13(11)9-12)18-15-3-1-2-8-17-15/h1-5,8-9,14,21H,6-7,10H2,(H,17,18)(H,19,20)
InChIKeyAEYZGBBUAPCNAU-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.17
Rot. Bonds3

About N-hydroxy-7-(pyridin-2-ylamino)-5,6,7,8-tetrahydronaphthalene-2-carboxamide

N-hydroxy-7-(pyridin-2-ylamino)-5,6,7,8-tetrahydronaphthalene-2-carboxamide (PubChem CID 56932650) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is N-hydroxy-7-(pyridin-2-ylamino)-5,6,7,8-tetrahydronaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-hydroxy-7-(pyridin-2-ylamino)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
PubChem CID56932650
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC NameN-hydroxy-7-(pyridin-2-ylamino)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
SMILESO=C(NO)c1ccc2c(c1)CC(Nc1ccccn1)CC2
InChIInChI=1S/C16H17N3O2/c20-16(19-21)12-5-4-11-6-7-14(10-13(11)9-12)18-15-3-1-2-8-17-15/h1-5,8-9,14,21H,6-7,10H2,(H,17,18)(H,19,20)
InChIKeyAEYZGBBUAPCNAU-UHFFFAOYSA-N
XLogP2.17
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-7-(pyridin-2-ylamino)-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
The IUPAC name of N-hydroxy-7-(pyridin-2-ylamino)-5,6,7,8-tetrahydronaphthalene-2-carboxamide (CID 56932650) is N-hydroxy-7-(pyridin-2-ylamino)-5,6,7,8-tetrahydronaphthalene-2-carboxamide.
What is the SMILES notation for N-hydroxy-7-(pyridin-2-ylamino)-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
The canonical SMILES for N-hydroxy-7-(pyridin-2-ylamino)-5,6,7,8-tetrahydronaphthalene-2-carboxamide is O=C(NO)c1ccc2c(c1)CC(Nc1ccccn1)CC2.
What is the InChIKey of N-hydroxy-7-(pyridin-2-ylamino)-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
The InChIKey is AEYZGBBUAPCNAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c20-16(19-21)12-5-4-11-6-7-14(10-13(11)9-12)18-15-3-1-2-8-17-15/h1-5,8-9,14,21H,6-7,10H2,(H,17,18)(H,19,20).
What are the key properties of N-hydroxy-7-(pyridin-2-ylamino)-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
N-hydroxy-7-(pyridin-2-ylamino)-5,6,7,8-tetrahydronaphthalene-2-carboxamide has a molecular weight of 283.33 g/mol, XLogP of 2.17, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-7-(pyridin-2-ylamino)-5,6,7,8-tetrahydronaphthalene-2-carboxamide is sourced from PubChem (CID 56932650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).