N-(2-hydroxyethyl)pyridine-2-carboxamide;nitric acid

C8H11N3O5 — CID 157371793

IUPACN-(2-hydroxyethyl)pyridine-2-carboxamide;nitric acid
SMILESO=C(NCCO)c1ccccn1.O=[N+]([O-])O
InChIInChI=1S/C8H10N2O2.HNO3/c11-6-5-10-8(12)7-3-1-2-4-9-7;2-1(3)4/h1-4,11H,5-6H2,(H,10,12);(H,2,3,4)
InChIKeyBJVVIFZUGUVCBB-UHFFFAOYSA-N
MW229.19 g/mol
LogP-0.54
Rot. Bonds3

About N-(2-hydroxyethyl)pyridine-2-carboxamide;nitric acid

N-(2-hydroxyethyl)pyridine-2-carboxamide;nitric acid (PubChem CID 157371793) has the molecular formula C8H11N3O5 and a molecular weight of 229.19 g/mol. Its IUPAC name is N-(2-hydroxyethyl)pyridine-2-carboxamide;nitric acid.

Molecular Properties

Compound NameN-(2-hydroxyethyl)pyridine-2-carboxamide;nitric acid
PubChem CID157371793
Molecular FormulaC8H11N3O5
Molecular Weight229.19 g/mol
Exact Mass229.07
IUPAC NameN-(2-hydroxyethyl)pyridine-2-carboxamide;nitric acid
SMILESO=C(NCCO)c1ccccn1.O=[N+]([O-])O
InChIInChI=1S/C8H10N2O2.HNO3/c11-6-5-10-8(12)7-3-1-2-4-9-7;2-1(3)4/h1-4,11H,5-6H2,(H,10,12);(H,2,3,4)
InChIKeyBJVVIFZUGUVCBB-UHFFFAOYSA-N
XLogP-0.54
TPSA125.59 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.19
LogP ≤ 5-0.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[6-(pyridine-2-carbonylamino)hexyl]pyridine-2-carboxamide;hydrochloride
CID 54601367
N-(2-bromoethyl)pyridine-2-carboxamide
CID 12983473
N-[2-(2-hydroxyphenyl)ethyl]pyridine-2-carboxamide
CID 110672365
N-[2-[methyl-[2-(pyridine-2-carbonylamino)ethyl]amino]ethyl]pyridine-2-carboxamide
CID 15495474
N-(3-pyridin-2-ylpropyl)pyridine-2-carboxamide
CID 110660927
6-(pyridine-2-carbonylamino)hexanoic acid
CID 16792895
N-[2-[N-[2-(pyridine-2-carbonylamino)ethyl]anilino]ethyl]pyridine-2-carboxamide
CID 139085666
N-[2-(thiophene-2-carbonylamino)ethyl]pyridine-2-carboxamide
CID 108542652
N-(9-oxononyl)pyridine-2-carboxamide
CID 130335282
tert-butyl N-[2-(pyridine-2-carbonylamino)ethyl]carbamate
CID 47453309
acetic acid;N-ethylpyridine-2-carboxamide
CID 174901243
N-[2-(4-methylsulfonylphenyl)ethyl]pyridine-2-carboxamide
CID 110795964

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)pyridine-2-carboxamide;nitric acid?
The IUPAC name of N-(2-hydroxyethyl)pyridine-2-carboxamide;nitric acid (CID 157371793) is N-(2-hydroxyethyl)pyridine-2-carboxamide;nitric acid.
What is the SMILES notation for N-(2-hydroxyethyl)pyridine-2-carboxamide;nitric acid?
The canonical SMILES for N-(2-hydroxyethyl)pyridine-2-carboxamide;nitric acid is O=C(NCCO)c1ccccn1.O=[N+]([O-])O.
What is the InChIKey of N-(2-hydroxyethyl)pyridine-2-carboxamide;nitric acid?
The InChIKey is BJVVIFZUGUVCBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2.HNO3/c11-6-5-10-8(12)7-3-1-2-4-9-7;2-1(3)4/h1-4,11H,5-6H2,(H,10,12);(H,2,3,4).
What are the key properties of N-(2-hydroxyethyl)pyridine-2-carboxamide;nitric acid?
N-(2-hydroxyethyl)pyridine-2-carboxamide;nitric acid has a molecular weight of 229.19 g/mol, XLogP of -0.54, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)pyridine-2-carboxamide;nitric acid is sourced from PubChem (CID 157371793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).