N-[(5-amino-1H-pyrazol-4-yl)methyl]-1-hydroxynaphthalene-2-carboxamide

C15H14N4O2 — CID 79530279

IUPACN-[(5-amino-1H-pyrazol-4-yl)methyl]-1-hydroxynaphthalene-2-carboxamide
SMILESNc1[nH]ncc1CNC(=O)c1ccc2ccccc2c1O
InChIInChI=1S/C15H14N4O2/c16-14-10(8-18-19-14)7-17-15(21)12-6-5-9-3-1-2-4-11(9)13(12)20/h1-6,8,20H,7H2,(H,17,21)(H3,16,18,19)
InChIKeyFJLGJDJDWMLAQZ-UHFFFAOYSA-N
MW282.30 g/mol
LogP1.78
Rot. Bonds3

About N-[(5-amino-1H-pyrazol-4-yl)methyl]-1-hydroxynaphthalene-2-carboxamide

N-[(5-amino-1H-pyrazol-4-yl)methyl]-1-hydroxynaphthalene-2-carboxamide (PubChem CID 79530279) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is N-[(5-amino-1H-pyrazol-4-yl)methyl]-1-hydroxynaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[(5-amino-1H-pyrazol-4-yl)methyl]-1-hydroxynaphthalene-2-carboxamide
PubChem CID79530279
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC NameN-[(5-amino-1H-pyrazol-4-yl)methyl]-1-hydroxynaphthalene-2-carboxamide
SMILESNc1[nH]ncc1CNC(=O)c1ccc2ccccc2c1O
InChIInChI=1S/C15H14N4O2/c16-14-10(8-18-19-14)7-17-15(21)12-6-5-9-3-1-2-4-11(9)13(12)20/h1-6,8,20H,7H2,(H,17,21)(H3,16,18,19)
InChIKeyFJLGJDJDWMLAQZ-UHFFFAOYSA-N
XLogP1.78
TPSA104.03 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 51.78
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

1-hydroxy-N-(1H-pyrazol-5-ylmethyl)naphthalene-2-carboxamide
CID 60975854
N-[(5-amino-1H-pyrazol-4-yl)methyl]-4-chloro-2-hydroxybenzamide
CID 79531317
N-[(5-amino-1H-pyrazol-4-yl)methyl]-4-hydroxybenzamide
CID 79529688
N-[(5-amino-1H-pyrazol-4-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103120944
N-[(5-amino-1H-pyrazol-4-yl)methyl]-2-phenylsulfanylacetamide
CID 79531033
N-[(5-amino-1H-pyrazol-4-yl)methyl]-2-chlorofuran-3-carboxamide
CID 106688560
N-[(5-amino-1H-pyrazol-4-yl)methyl]-2-pyridin-3-ylacetamide
CID 79529546
N-[(5-amino-1H-pyrazol-4-yl)methyl]-2-phenoxyacetamide
CID 79530146
N-[(5-amino-1H-pyrazol-4-yl)methyl]-4-chlorobenzamide
CID 79530127
N-[(5-amino-1H-pyrazol-4-yl)methyl]thiadiazole-5-carboxamide
CID 79531188
N-[(5-amino-1H-pyrazol-4-yl)methyl]-3,4-dichlorobenzamide
CID 79530307
N-[(5-amino-1H-pyrazol-4-yl)methyl]quinoline-6-carboxamide
CID 79529850

Frequently Asked Questions

What is the IUPAC name of N-[(5-amino-1H-pyrazol-4-yl)methyl]-1-hydroxynaphthalene-2-carboxamide?
The IUPAC name of N-[(5-amino-1H-pyrazol-4-yl)methyl]-1-hydroxynaphthalene-2-carboxamide (CID 79530279) is N-[(5-amino-1H-pyrazol-4-yl)methyl]-1-hydroxynaphthalene-2-carboxamide.
What is the SMILES notation for N-[(5-amino-1H-pyrazol-4-yl)methyl]-1-hydroxynaphthalene-2-carboxamide?
The canonical SMILES for N-[(5-amino-1H-pyrazol-4-yl)methyl]-1-hydroxynaphthalene-2-carboxamide is Nc1[nH]ncc1CNC(=O)c1ccc2ccccc2c1O.
What is the InChIKey of N-[(5-amino-1H-pyrazol-4-yl)methyl]-1-hydroxynaphthalene-2-carboxamide?
The InChIKey is FJLGJDJDWMLAQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c16-14-10(8-18-19-14)7-17-15(21)12-6-5-9-3-1-2-4-11(9)13(12)20/h1-6,8,20H,7H2,(H,17,21)(H3,16,18,19).
What are the key properties of N-[(5-amino-1H-pyrazol-4-yl)methyl]-1-hydroxynaphthalene-2-carboxamide?
N-[(5-amino-1H-pyrazol-4-yl)methyl]-1-hydroxynaphthalene-2-carboxamide has a molecular weight of 282.30 g/mol, XLogP of 1.78, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-amino-1H-pyrazol-4-yl)methyl]-1-hydroxynaphthalene-2-carboxamide is sourced from PubChem (CID 79530279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).