N-(3-ethyl-2-morpholin-4-ylpentyl)-4-(methylamino)butanamide;dihydrochloride

C16H35Cl2N3O2 — CID 119841667

IUPACN-(3-ethyl-2-morpholin-4-ylpentyl)-4-(methylamino)butanamide;dihydrochloride
SMILESCCC(CC)C(CNC(=O)CCCNC)N1CCOCC1.Cl.Cl
InChIInChI=1S/C16H33N3O2.2ClH/c1-4-14(5-2)15(19-9-11-21-12-10-19)13-18-16(20)7-6-8-17-3;;/h14-15,17H,4-13H2,1-3H3,(H,18,20);2*1H
InChIKeyPTLVSVHWUOQCSA-UHFFFAOYSA-N
MW372.38 g/mol
LogP2.08
Rot. Bonds10

About N-(3-ethyl-2-morpholin-4-ylpentyl)-4-(methylamino)butanamide;dihydrochloride

N-(3-ethyl-2-morpholin-4-ylpentyl)-4-(methylamino)butanamide;dihydrochloride (PubChem CID 119841667) has the molecular formula C16H35Cl2N3O2 and a molecular weight of 372.38 g/mol. Its IUPAC name is N-(3-ethyl-2-morpholin-4-ylpentyl)-4-(methylamino)butanamide;dihydrochloride.

Molecular Properties

Compound NameN-(3-ethyl-2-morpholin-4-ylpentyl)-4-(methylamino)butanamide;dihydrochloride
PubChem CID119841667
Molecular FormulaC16H35Cl2N3O2
Molecular Weight372.38 g/mol
Exact Mass371.21
IUPAC NameN-(3-ethyl-2-morpholin-4-ylpentyl)-4-(methylamino)butanamide;dihydrochloride
SMILESCCC(CC)C(CNC(=O)CCCNC)N1CCOCC1.Cl.Cl
InChIInChI=1S/C16H33N3O2.2ClH/c1-4-14(5-2)15(19-9-11-21-12-10-19)13-18-16(20)7-6-8-17-3;;/h14-15,17H,4-13H2,1-3H3,(H,18,20);2*1H
InChIKeyPTLVSVHWUOQCSA-UHFFFAOYSA-N
XLogP2.08
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.38
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-acetamido-N-(3-ethyl-2-morpholin-4-ylpentyl)hexanamide
CID 55634041
4-(methylamino)-N-(2-morpholin-4-ylpropyl)butanamide;dihydrochloride
CID 119849872
1-amino-N-(3-ethyl-2-morpholin-4-ylpentyl)cyclopropane-1-carboxamide
CID 119841656
3-ethyl-N-[3-(methylamino)propyl]-2-morpholin-4-ylpentanamide;dihydrochloride
CID 119432428
N-(3-ethyl-2-morpholin-4-ylpentyl)-3-(4-methoxyphenyl)propanamide
CID 75691751
2-(cyclopropylmethylamino)-N-(3-ethyl-2-morpholin-4-ylpentyl)acetamide
CID 119841694
N-(3-ethyl-2-morpholin-4-ylpentyl)-4-(4-ethylphenyl)-4-oxobutanamide
CID 55550061
N-(3-ethyl-2-morpholin-4-ylpentyl)-3-(1,2,4-triazol-1-yl)propanamide
CID 134053148
N-(3-ethyl-2-morpholin-4-ylpentyl)-3-thiophen-3-ylpropanamide
CID 134053099
4-(methylamino)-N-[3-methyl-2-(4-methylpiperidin-1-yl)butyl]butanamide;dihydrochloride
CID 119849813
N-(3-ethyl-2-morpholin-4-ylpentyl)-3-[[(E)-2-phenylethenyl]sulfonylamino]propanamide
CID 55550446
N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-4-(methylamino)butanamide;dihydrochloride
CID 119830133

Frequently Asked Questions

What is the IUPAC name of N-(3-ethyl-2-morpholin-4-ylpentyl)-4-(methylamino)butanamide;dihydrochloride?
The IUPAC name of N-(3-ethyl-2-morpholin-4-ylpentyl)-4-(methylamino)butanamide;dihydrochloride (CID 119841667) is N-(3-ethyl-2-morpholin-4-ylpentyl)-4-(methylamino)butanamide;dihydrochloride.
What is the SMILES notation for N-(3-ethyl-2-morpholin-4-ylpentyl)-4-(methylamino)butanamide;dihydrochloride?
The canonical SMILES for N-(3-ethyl-2-morpholin-4-ylpentyl)-4-(methylamino)butanamide;dihydrochloride is CCC(CC)C(CNC(=O)CCCNC)N1CCOCC1.Cl.Cl.
What is the InChIKey of N-(3-ethyl-2-morpholin-4-ylpentyl)-4-(methylamino)butanamide;dihydrochloride?
The InChIKey is PTLVSVHWUOQCSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O2.2ClH/c1-4-14(5-2)15(19-9-11-21-12-10-19)13-18-16(20)7-6-8-17-3;;/h14-15,17H,4-13H2,1-3H3,(H,18,20);2*1H.
What are the key properties of N-(3-ethyl-2-morpholin-4-ylpentyl)-4-(methylamino)butanamide;dihydrochloride?
N-(3-ethyl-2-morpholin-4-ylpentyl)-4-(methylamino)butanamide;dihydrochloride has a molecular weight of 372.38 g/mol, XLogP of 2.08, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-2-morpholin-4-ylpentyl)-4-(methylamino)butanamide;dihydrochloride is sourced from PubChem (CID 119841667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).