2-(5-amino-2-pyridinyl)-N,N-diethylacetamide;hydrochloride

C11H18ClN3O — CID 120616165

IUPAC2-(5-amino-2-pyridinyl)-N,N-diethylacetamide;hydrochloride
SMILESCCN(CC)C(=O)Cc1ccc(N)cn1.Cl
InChIInChI=1S/C11H17N3O.ClH/c1-3-14(4-2)11(15)7-10-6-5-9(12)8-13-10;/h5-6,8H,3-4,7,12H2,1-2H3;1H
InChIKeyHTQTYCCYOAJVRD-UHFFFAOYSA-N
MW243.74 g/mol
LogP1.50
Rot. Bonds4

About 2-(5-amino-2-pyridinyl)-N,N-diethylacetamide;hydrochloride

2-(5-amino-2-pyridinyl)-N,N-diethylacetamide;hydrochloride (PubChem CID 120616165) has the molecular formula C11H18ClN3O and a molecular weight of 243.74 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N,N-diethylacetamide;hydrochloride.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N,N-diethylacetamide;hydrochloride
PubChem CID120616165
Molecular FormulaC11H18ClN3O
Molecular Weight243.74 g/mol
Exact Mass243.11
IUPAC Name2-(5-amino-2-pyridinyl)-N,N-diethylacetamide;hydrochloride
SMILESCCN(CC)C(=O)Cc1ccc(N)cn1.Cl
InChIInChI=1S/C11H17N3O.ClH/c1-3-14(4-2)11(15)7-10-6-5-9(12)8-13-10;/h5-6,8H,3-4,7,12H2,1-2H3;1H
InChIKeyHTQTYCCYOAJVRD-UHFFFAOYSA-N
XLogP1.50
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.74
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-amino-2-pyridinyl)-N-(cyclopropylmethyl)-N-ethylacetamide;hydrochloride
CID 120632760
2-(5-amino-2-pyridinyl)-N-ethyl-N-propan-2-ylacetamide;hydrochloride
CID 120620159
2-(5-amino-2-pyridinyl)-N-ethyl-N-(oxolan-2-ylmethyl)acetamide;hydrochloride
CID 120625769
4-[2-(5-amino-2-pyridinyl)acetyl]-N,N-diethylpiperazine-1-carboxamide;hydrochloride
CID 120621767
2-(5-amino-2-pyridinyl)-N-[2-oxo-2-(propylamino)ethyl]-N-propylacetamide;hydrochloride
CID 120624579
N-(2-amino-2-oxoethyl)-2-(5-amino-2-pyridinyl)-N-(2-methylpropyl)acetamide
CID 107338053
2-(5-amino-2-pyridinyl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)acetamide
CID 107339531
2-(5-amino-2-pyridinyl)-N-ethyl-N-(3-hydroxyphenyl)acetamide
CID 107735033
2-(5-amino-2-pyridinyl)-N-cyclopropyl-N-[(4-ethylphenyl)methyl]acetamide;hydrochloride
CID 120621354
2-(5-amino-2-pyridinyl)-N-methyl-N-[1-(4-methylphenyl)ethyl]acetamide
CID 107337980
2-(5-amino-2-pyridinyl)-N-methyl-N-[(2-methylphenyl)methyl]acetamide;hydrochloride
CID 120617349
2-(5-amino-2-pyridinyl)-N-methyl-N-(3,3,3-trifluoropropyl)acetamide
CID 107339049

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N,N-diethylacetamide;hydrochloride?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N,N-diethylacetamide;hydrochloride (CID 120616165) is 2-(5-amino-2-pyridinyl)-N,N-diethylacetamide;hydrochloride.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N,N-diethylacetamide;hydrochloride?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N,N-diethylacetamide;hydrochloride is CCN(CC)C(=O)Cc1ccc(N)cn1.Cl.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N,N-diethylacetamide;hydrochloride?
The InChIKey is HTQTYCCYOAJVRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O.ClH/c1-3-14(4-2)11(15)7-10-6-5-9(12)8-13-10;/h5-6,8H,3-4,7,12H2,1-2H3;1H.
What are the key properties of 2-(5-amino-2-pyridinyl)-N,N-diethylacetamide;hydrochloride?
2-(5-amino-2-pyridinyl)-N,N-diethylacetamide;hydrochloride has a molecular weight of 243.74 g/mol, XLogP of 1.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N,N-diethylacetamide;hydrochloride is sourced from PubChem (CID 120616165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).