4-amino-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride

C13H22Cl2N4O2 — CID 119845870

IUPAC4-amino-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride
SMILESCl.Cl.NCCCC(=O)Nc1cccnc1N1CCOCC1
InChIInChI=1S/C13H20N4O2.2ClH/c14-5-1-4-12(18)16-11-3-2-6-15-13(11)17-7-9-19-10-8-17;;/h2-3,6H,1,4-5,7-10,14H2,(H,16,18);2*1H
InChIKeyDVKAXDZKHPIFAL-UHFFFAOYSA-N
MW337.25 g/mol
LogP1.44
Rot. Bonds5

About 4-amino-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride

4-amino-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride (PubChem CID 119845870) has the molecular formula C13H22Cl2N4O2 and a molecular weight of 337.25 g/mol. Its IUPAC name is 4-amino-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride.

Molecular Properties

Compound Name4-amino-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride
PubChem CID119845870
Molecular FormulaC13H22Cl2N4O2
Molecular Weight337.25 g/mol
Exact Mass336.11
IUPAC Name4-amino-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride
SMILESCl.Cl.NCCCC(=O)Nc1cccnc1N1CCOCC1
InChIInChI=1S/C13H20N4O2.2ClH/c14-5-1-4-12(18)16-11-3-2-6-15-13(11)17-7-9-19-10-8-17;;/h2-3,6H,1,4-5,7-10,14H2,(H,16,18);2*1H
InChIKeyDVKAXDZKHPIFAL-UHFFFAOYSA-N
XLogP1.44
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.25
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-methylphenyl)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide
CID 60576563
6-amino-N-(2-morpholin-4-ylphenyl)hexanamide
CID 43708115
3-(benzimidazol-1-yl)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide
CID 60576832
3-amino-2-methyl-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride
CID 120502859
2-amino-N-(2-morpholin-4-yl-3-pyridinyl)pentanamide;dihydrochloride
CID 119845832
7-amino-N-(3-chloro-2-morpholin-4-ylphenyl)heptanamide;dihydrochloride
CID 119840505
N-(2-morpholin-4-yl-3-pyridinyl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide
CID 60576683
7-amino-N-(2-pyrazol-1-yl-3-pyridinyl)heptanamide
CID 43714218
4-amino-N-(2,4-dimorpholin-4-ylphenyl)butanamide
CID 119900958
2-methyl-3-(methylamino)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide;dihydrochloride
CID 119845852
2-(1,3-benzodioxol-5-yl)-N-(2-morpholin-4-yl-3-pyridinyl)acetamide
CID 75405128
N-(2-morpholin-4-yl-3-pyridinyl)-2-pyrrolidin-2-ylacetamide
CID 119845865

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride?
The IUPAC name of 4-amino-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride (CID 119845870) is 4-amino-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride.
What is the SMILES notation for 4-amino-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride?
The canonical SMILES for 4-amino-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride is Cl.Cl.NCCCC(=O)Nc1cccnc1N1CCOCC1.
What is the InChIKey of 4-amino-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride?
The InChIKey is DVKAXDZKHPIFAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2.2ClH/c14-5-1-4-12(18)16-11-3-2-6-15-13(11)17-7-9-19-10-8-17;;/h2-3,6H,1,4-5,7-10,14H2,(H,16,18);2*1H.
What are the key properties of 4-amino-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride?
4-amino-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride has a molecular weight of 337.25 g/mol, XLogP of 1.44, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride is sourced from PubChem (CID 119845870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).