2-(5-amino-2-pyridinyl)-N-(2-bicyclo[2.2.1]heptanyl)acetamide;hydrochloride

C14H20ClN3O — CID 120633899

IUPAC2-(5-amino-2-pyridinyl)-N-(2-bicyclo[2.2.1]heptanyl)acetamide;hydrochloride
SMILESCl.Nc1ccc(CC(=O)NC2CC3CCC2C3)nc1
InChIInChI=1S/C14H19N3O.ClH/c15-11-3-4-12(16-8-11)7-14(18)17-13-6-9-1-2-10(13)5-9;/h3-4,8-10,13H,1-2,5-7,15H2,(H,17,18);1H
InChIKeyNKEVNPLIJQWXKU-UHFFFAOYSA-N
MW281.79 g/mol
LogP1.93
Rot. Bonds3

About 2-(5-amino-2-pyridinyl)-N-(2-bicyclo[2.2.1]heptanyl)acetamide;hydrochloride

2-(5-amino-2-pyridinyl)-N-(2-bicyclo[2.2.1]heptanyl)acetamide;hydrochloride (PubChem CID 120633899) has the molecular formula C14H20ClN3O and a molecular weight of 281.79 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N-(2-bicyclo[2.2.1]heptanyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N-(2-bicyclo[2.2.1]heptanyl)acetamide;hydrochloride
PubChem CID120633899
Molecular FormulaC14H20ClN3O
Molecular Weight281.79 g/mol
Exact Mass281.13
IUPAC Name2-(5-amino-2-pyridinyl)-N-(2-bicyclo[2.2.1]heptanyl)acetamide;hydrochloride
SMILESCl.Nc1ccc(CC(=O)NC2CC3CCC2C3)nc1
InChIInChI=1S/C14H19N3O.ClH/c15-11-3-4-12(16-8-11)7-14(18)17-13-6-9-1-2-10(13)5-9;/h3-4,8-10,13H,1-2,5-7,15H2,(H,17,18);1H
InChIKeyNKEVNPLIJQWXKU-UHFFFAOYSA-N
XLogP1.93
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.79
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-amino-2-pyridinyl)-N-(2-methylcycloheptyl)acetamide
CID 107339059
2-(5-amino-2-pyridinyl)-N-(2-tert-butylcyclohexyl)acetamide;hydrochloride
CID 120621478
2-(5-amino-2-pyridinyl)-N-(4,4-dimethylcyclohexyl)acetamide;hydrochloride
CID 120633539
2-(5-amino-2-pyridinyl)-N-cyclohex-3-en-1-ylacetamide
CID 107339064
2-(5-amino-2-pyridinyl)-N-(oxolan-3-yl)acetamide
CID 107339286
2-(5-amino-2-pyridinyl)-N-(2-methoxycyclopentyl)acetamide
CID 107338628
2-(5-amino-2-pyridinyl)-N-(3-ethyl-2-methylcyclopentyl)acetamide
CID 107338994
4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide
CID 107337718
2-(5-amino-2-pyridinyl)-N-(2-cyclopropylethyl)acetamide;hydrochloride
CID 120633863
2-(5-amino-2-pyridinyl)-N-(1-cyclopropylpiperidin-4-yl)acetamide
CID 107337839
2-(5-amino-2-pyridinyl)-N-(thiolan-3-yl)acetamide
CID 107339832
2-(5-amino-2-pyridinyl)-N-(1-propylsulfonylpiperidin-4-yl)acetamide;hydrochloride
CID 120620773

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N-(2-bicyclo[2.2.1]heptanyl)acetamide;hydrochloride?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N-(2-bicyclo[2.2.1]heptanyl)acetamide;hydrochloride (CID 120633899) is 2-(5-amino-2-pyridinyl)-N-(2-bicyclo[2.2.1]heptanyl)acetamide;hydrochloride.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N-(2-bicyclo[2.2.1]heptanyl)acetamide;hydrochloride?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N-(2-bicyclo[2.2.1]heptanyl)acetamide;hydrochloride is Cl.Nc1ccc(CC(=O)NC2CC3CCC2C3)nc1.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N-(2-bicyclo[2.2.1]heptanyl)acetamide;hydrochloride?
The InChIKey is NKEVNPLIJQWXKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O.ClH/c15-11-3-4-12(16-8-11)7-14(18)17-13-6-9-1-2-10(13)5-9;/h3-4,8-10,13H,1-2,5-7,15H2,(H,17,18);1H.
What are the key properties of 2-(5-amino-2-pyridinyl)-N-(2-bicyclo[2.2.1]heptanyl)acetamide;hydrochloride?
2-(5-amino-2-pyridinyl)-N-(2-bicyclo[2.2.1]heptanyl)acetamide;hydrochloride has a molecular weight of 281.79 g/mol, XLogP of 1.93, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N-(2-bicyclo[2.2.1]heptanyl)acetamide;hydrochloride is sourced from PubChem (CID 120633899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).