1-hydroxy-N-(1H-pyrazol-5-ylmethyl)naphthalene-2-carboxamide

C15H13N3O2 — CID 60975854

IUPAC1-hydroxy-N-(1H-pyrazol-5-ylmethyl)naphthalene-2-carboxamide
SMILESO=C(NCc1ccn[nH]1)c1ccc2ccccc2c1O
InChIInChI=1S/C15H13N3O2/c19-14-12-4-2-1-3-10(12)5-6-13(14)15(20)16-9-11-7-8-17-18-11/h1-8,19H,9H2,(H,16,20)(H,17,18)
InChIKeyJWWZAOCSVVMOKO-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.20
Rot. Bonds3

About 1-hydroxy-N-(1H-pyrazol-5-ylmethyl)naphthalene-2-carboxamide

1-hydroxy-N-(1H-pyrazol-5-ylmethyl)naphthalene-2-carboxamide (PubChem CID 60975854) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is 1-hydroxy-N-(1H-pyrazol-5-ylmethyl)naphthalene-2-carboxamide.

Molecular Properties

Compound Name1-hydroxy-N-(1H-pyrazol-5-ylmethyl)naphthalene-2-carboxamide
PubChem CID60975854
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC Name1-hydroxy-N-(1H-pyrazol-5-ylmethyl)naphthalene-2-carboxamide
SMILESO=C(NCc1ccn[nH]1)c1ccc2ccccc2c1O
InChIInChI=1S/C15H13N3O2/c19-14-12-4-2-1-3-10(12)5-6-13(14)15(20)16-9-11-7-8-17-18-11/h1-8,19H,9H2,(H,16,20)(H,17,18)
InChIKeyJWWZAOCSVVMOKO-UHFFFAOYSA-N
XLogP2.20
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dihydroxy-N-(1H-pyrazol-5-ylmethyl)benzamide
CID 114344962
2-amino-N-(1H-pyrazol-5-ylmethyl)benzamide
CID 61285252
N-[(5-amino-1H-pyrazol-4-yl)methyl]-1-hydroxynaphthalene-2-carboxamide
CID 79530279
2,6-dihydroxy-N-(1H-pyrazol-5-ylmethyl)benzamide
CID 113346790
1-prop-2-enyl-N-(1H-pyrazol-5-ylmethyl)indole-3-carboxamide
CID 56819715
4-methyl-N-(1H-pyrazol-5-ylmethyl)thiophene-3-carboxamide
CID 79777719
2-methyl-N-(1H-pyrazol-5-ylmethyl)furan-3-carboxamide
CID 47285848
3-oxo-3-(1H-pyrazol-5-ylmethylamino)propanoic acid
CID 62232296
N-but-2-ynyl-1-hydroxynaphthalene-2-carboxamide
CID 113342440
4-iodo-N-(1H-pyrazol-5-ylmethyl)benzamide
CID 47204233
N-cyclopent-3-en-1-yl-1-hydroxynaphthalene-2-carboxamide
CID 115696816
N-(1H-pyrazol-5-ylmethyl)-1H-pyrazole-4-carboxamide
CID 60975279

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-N-(1H-pyrazol-5-ylmethyl)naphthalene-2-carboxamide?
The IUPAC name of 1-hydroxy-N-(1H-pyrazol-5-ylmethyl)naphthalene-2-carboxamide (CID 60975854) is 1-hydroxy-N-(1H-pyrazol-5-ylmethyl)naphthalene-2-carboxamide.
What is the SMILES notation for 1-hydroxy-N-(1H-pyrazol-5-ylmethyl)naphthalene-2-carboxamide?
The canonical SMILES for 1-hydroxy-N-(1H-pyrazol-5-ylmethyl)naphthalene-2-carboxamide is O=C(NCc1ccn[nH]1)c1ccc2ccccc2c1O.
What is the InChIKey of 1-hydroxy-N-(1H-pyrazol-5-ylmethyl)naphthalene-2-carboxamide?
The InChIKey is JWWZAOCSVVMOKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c19-14-12-4-2-1-3-10(12)5-6-13(14)15(20)16-9-11-7-8-17-18-11/h1-8,19H,9H2,(H,16,20)(H,17,18).
What are the key properties of 1-hydroxy-N-(1H-pyrazol-5-ylmethyl)naphthalene-2-carboxamide?
1-hydroxy-N-(1H-pyrazol-5-ylmethyl)naphthalene-2-carboxamide has a molecular weight of 267.29 g/mol, XLogP of 2.20, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-N-(1H-pyrazol-5-ylmethyl)naphthalene-2-carboxamide is sourced from PubChem (CID 60975854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).