2-[2-(2-aminoethoxy)ethyl]pyridine-3-carboxamide

C10H15N3O2 — CID 172813947

IUPAC2-[2-(2-aminoethoxy)ethyl]pyridine-3-carboxamide
SMILESNCCOCCc1ncccc1C(N)=O
InChIInChI=1S/C10H15N3O2/c11-4-7-15-6-3-9-8(10(12)14)2-1-5-13-9/h1-2,5H,3-4,6-7,11H2,(H2,12,14)
InChIKeySOHMCJCUYBMIPL-UHFFFAOYSA-N
MW209.25 g/mol
LogP-0.30
Rot. Bonds6

About 2-[2-(2-aminoethoxy)ethyl]pyridine-3-carboxamide

2-[2-(2-aminoethoxy)ethyl]pyridine-3-carboxamide (PubChem CID 172813947) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 2-[2-(2-aminoethoxy)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-[2-(2-aminoethoxy)ethyl]pyridine-3-carboxamide
PubChem CID172813947
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name2-[2-(2-aminoethoxy)ethyl]pyridine-3-carboxamide
SMILESNCCOCCc1ncccc1C(N)=O
InChIInChI=1S/C10H15N3O2/c11-4-7-15-6-3-9-8(10(12)14)2-1-5-13-9/h1-2,5H,3-4,6-7,11H2,(H2,12,14)
InChIKeySOHMCJCUYBMIPL-UHFFFAOYSA-N
XLogP-0.30
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(3-propan-2-yloxypropyl)pyridine-3-carboxamide
CID 154375550
2-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-3-carboxamide
CID 67232650
2-benzylpyridine-3-carboxamide;dihydrochloride
CID 141007334
2-(2-acetyloxyethyl)pyridine-3-carboxylic acid
CID 166055626
2-[(4-hydroxyphenyl)methyl]pyridine-3-carboxamide
CID 142681726
ethyl 2-(3-aminopropyl)pyridine-3-carboxylate
CID 70281941
2-[(3,4-dimethoxyphenyl)methyl]pyridine-3-carboxamide
CID 66964231
2-[3-(2-hydroxyethoxy)propylamino]pyridine-3-carboxamide
CID 113362577
2-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide
CID 176827176
2-[12-(4-hydroxypiperidin-1-yl)dodecyl]pyridine-3-carboxamide
CID 178064385
N-[3-(2-aminoethoxy)propyl]quinoline-5-carboxamide
CID 106307791
2-(trifluoromethyl)pyridine-3-carboxamide
CID 6425058

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminoethoxy)ethyl]pyridine-3-carboxamide?
The IUPAC name of 2-[2-(2-aminoethoxy)ethyl]pyridine-3-carboxamide (CID 172813947) is 2-[2-(2-aminoethoxy)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-[2-(2-aminoethoxy)ethyl]pyridine-3-carboxamide?
The canonical SMILES for 2-[2-(2-aminoethoxy)ethyl]pyridine-3-carboxamide is NCCOCCc1ncccc1C(N)=O.
What is the InChIKey of 2-[2-(2-aminoethoxy)ethyl]pyridine-3-carboxamide?
The InChIKey is SOHMCJCUYBMIPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c11-4-7-15-6-3-9-8(10(12)14)2-1-5-13-9/h1-2,5H,3-4,6-7,11H2,(H2,12,14).
What are the key properties of 2-[2-(2-aminoethoxy)ethyl]pyridine-3-carboxamide?
2-[2-(2-aminoethoxy)ethyl]pyridine-3-carboxamide has a molecular weight of 209.25 g/mol, XLogP of -0.30, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-aminoethoxy)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 172813947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).