2-(5-amino-2-pyridinyl)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride

C15H26Cl2N4O — CID 120642533

IUPAC2-(5-amino-2-pyridinyl)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride
SMILESCC1CCN(CCNC(=O)Cc2ccc(N)cn2)CC1.Cl.Cl
InChIInChI=1S/C15H24N4O.2ClH/c1-12-4-7-19(8-5-12)9-6-17-15(20)10-14-3-2-13(16)11-18-14;;/h2-3,11-12H,4-10,16H2,1H3,(H,17,20);2*1H
InChIKeyZIYCPCQBUPPEPE-UHFFFAOYSA-N
MW349.31 g/mol
LogP1.90
Rot. Bonds5

About 2-(5-amino-2-pyridinyl)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride

2-(5-amino-2-pyridinyl)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride (PubChem CID 120642533) has the molecular formula C15H26Cl2N4O and a molecular weight of 349.31 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride
PubChem CID120642533
Molecular FormulaC15H26Cl2N4O
Molecular Weight349.31 g/mol
Exact Mass348.15
IUPAC Name2-(5-amino-2-pyridinyl)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride
SMILESCC1CCN(CCNC(=O)Cc2ccc(N)cn2)CC1.Cl.Cl
InChIInChI=1S/C15H24N4O.2ClH/c1-12-4-7-19(8-5-12)9-6-17-15(20)10-14-3-2-13(16)11-18-14;;/h2-3,11-12H,4-10,16H2,1H3,(H,17,20);2*1H
InChIKeyZIYCPCQBUPPEPE-UHFFFAOYSA-N
XLogP1.90
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.31
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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2-(5-amino-2-pyridinyl)-N-(2-methoxyethyl)acetamide
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CID 107338827
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CID 107339670
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CID 107339282
2-(5-amino-2-pyridinyl)-N-(3-oxo-3-piperidin-1-ylpropyl)acetamide
CID 107339590
1-[2-[[2-(5-amino-2-pyridinyl)acetyl]amino]ethyl]triazole-4-carboxylic acid
CID 107500286
2-(5-amino-2-pyridinyl)-N-(3-methoxypropyl)acetamide
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2-(5-amino-2-pyridinyl)-N-octylacetamide
CID 107339440

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride (CID 120642533) is 2-(5-amino-2-pyridinyl)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride is CC1CCN(CCNC(=O)Cc2ccc(N)cn2)CC1.Cl.Cl.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride?
The InChIKey is ZIYCPCQBUPPEPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O.2ClH/c1-12-4-7-19(8-5-12)9-6-17-15(20)10-14-3-2-13(16)11-18-14;;/h2-3,11-12H,4-10,16H2,1H3,(H,17,20);2*1H.
What are the key properties of 2-(5-amino-2-pyridinyl)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride?
2-(5-amino-2-pyridinyl)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride has a molecular weight of 349.31 g/mol, XLogP of 1.90, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N-[2-(4-methylpiperidin-1-yl)ethyl]acetamide;dihydrochloride is sourced from PubChem (CID 120642533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).