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

C14H24Cl2N4O2 — CID 120502859

IUPAC3-amino-2-methyl-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride
SMILESCC(N)C(C)C(=O)Nc1cccnc1N1CCOCC1.Cl.Cl
InChIInChI=1S/C14H22N4O2.2ClH/c1-10(11(2)15)14(19)17-12-4-3-5-16-13(12)18-6-8-20-9-7-18;;/h3-5,10-11H,6-9,15H2,1-2H3,(H,17,19);2*1H
InChIKeyOHXJZZQOYDQVPR-UHFFFAOYSA-N
MW351.28 g/mol
LogP1.68
Rot. Bonds4

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

3-amino-2-methyl-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride (PubChem CID 120502859) has the molecular formula C14H24Cl2N4O2 and a molecular weight of 351.28 g/mol. Its IUPAC name is 3-amino-2-methyl-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride.

Molecular Properties

Compound Name3-amino-2-methyl-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride
PubChem CID120502859
Molecular FormulaC14H24Cl2N4O2
Molecular Weight351.28 g/mol
Exact Mass350.13
IUPAC Name3-amino-2-methyl-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride
SMILESCC(N)C(C)C(=O)Nc1cccnc1N1CCOCC1.Cl.Cl
InChIInChI=1S/C14H22N4O2.2ClH/c1-10(11(2)15)14(19)17-12-4-3-5-16-13(12)18-6-8-20-9-7-18;;/h3-5,10-11H,6-9,15H2,1-2H3,(H,17,19);2*1H
InChIKeyOHXJZZQOYDQVPR-UHFFFAOYSA-N
XLogP1.68
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.28
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-2-methyl-N-(2-morpholin-4-yl-3-pyridinyl)-3-phenylpropanamide
CID 119845839
2-amino-N-(2-morpholin-4-yl-3-pyridinyl)pentanamide;dihydrochloride
CID 119845832
2-methyl-3-(methylamino)-N-(2-morpholin-4-yl-3-pyridinyl)propanamide;dihydrochloride
CID 119845852
N-(2-morpholin-4-yl-3-pyridinyl)-N',N'-di(propan-2-yl)oxamide
CID 166442532
(2R)-2-amino-3-methyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)butanamide
CID 79011469
4-amino-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride
CID 119845870
2-morpholin-4-yl-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
CID 84576378
2-methyl-3-[methyl-[(2-morpholin-4-yl-3-pyridinyl)carbamoyl]amino]propanoic acid
CID 122077569
2-amino-3-methyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)pentanamide
CID 43700405
(E)-3-(4-methylphenyl)-N-(2-morpholin-4-yl-3-pyridinyl)prop-2-enamide
CID 60576829
2-methoxy-N-(2-pyrrolidin-1-yl-3-pyridinyl)propanamide
CID 47308006
1-ethyl-N-(2-morpholin-4-yl-3-pyridinyl)-3-propan-2-ylpyrazole-5-carboxamide
CID 86850082

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-methyl-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride?
The IUPAC name of 3-amino-2-methyl-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride (CID 120502859) is 3-amino-2-methyl-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride.
What is the SMILES notation for 3-amino-2-methyl-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride?
The canonical SMILES for 3-amino-2-methyl-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride is CC(N)C(C)C(=O)Nc1cccnc1N1CCOCC1.Cl.Cl.
What is the InChIKey of 3-amino-2-methyl-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride?
The InChIKey is OHXJZZQOYDQVPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2.2ClH/c1-10(11(2)15)14(19)17-12-4-3-5-16-13(12)18-6-8-20-9-7-18;;/h3-5,10-11H,6-9,15H2,1-2H3,(H,17,19);2*1H.
What are the key properties of 3-amino-2-methyl-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride?
3-amino-2-methyl-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride has a molecular weight of 351.28 g/mol, XLogP of 1.68, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-methyl-N-(2-morpholin-4-yl-3-pyridinyl)butanamide;dihydrochloride is sourced from PubChem (CID 120502859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).