N-[2-(dimethylamino)-3-ethylpentyl]-2-(2-methoxyethylamino)acetamide

C14H31N3O2 — CID 79280648

IUPACN-[2-(dimethylamino)-3-ethylpentyl]-2-(2-methoxyethylamino)acetamide
SMILESCCC(CC)C(CNC(=O)CNCCOC)N(C)C
InChIInChI=1S/C14H31N3O2/c1-6-12(7-2)13(17(3)4)10-16-14(18)11-15-8-9-19-5/h12-13,15H,6-11H2,1-5H3,(H,16,18)
InChIKeyUMSKXKQNRKFMFS-UHFFFAOYSA-N
MW273.42 g/mol
LogP0.70
Rot. Bonds11

About N-[2-(dimethylamino)-3-ethylpentyl]-2-(2-methoxyethylamino)acetamide

N-[2-(dimethylamino)-3-ethylpentyl]-2-(2-methoxyethylamino)acetamide (PubChem CID 79280648) has the molecular formula C14H31N3O2 and a molecular weight of 273.42 g/mol. Its IUPAC name is N-[2-(dimethylamino)-3-ethylpentyl]-2-(2-methoxyethylamino)acetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-3-ethylpentyl]-2-(2-methoxyethylamino)acetamide
PubChem CID79280648
Molecular FormulaC14H31N3O2
Molecular Weight273.42 g/mol
Exact Mass273.24
IUPAC NameN-[2-(dimethylamino)-3-ethylpentyl]-2-(2-methoxyethylamino)acetamide
SMILESCCC(CC)C(CNC(=O)CNCCOC)N(C)C
InChIInChI=1S/C14H31N3O2/c1-6-12(7-2)13(17(3)4)10-16-14(18)11-15-8-9-19-5/h12-13,15H,6-11H2,1-5H3,(H,16,18)
InChIKeyUMSKXKQNRKFMFS-UHFFFAOYSA-N
XLogP0.70
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 50.70
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

N-ethyl-2-(2-methoxyethylamino)acetamide
CID 28565523
N-(2,3-dihydroxypropyl)-2-(2-methoxyethylamino)acetamide
CID 79291770
N-[3-(dimethylamino)propyl]-2-(2-methoxyethylamino)acetamide;dihydrochloride
CID 119827417
N-[2-(dimethylamino)-3-ethylpentyl]-4-hydroxypentanamide
CID 79200682
N-(2-cyclopropyl-2-hydroxyethyl)-2-(2-methoxyethylamino)acetamide
CID 79280826
N-(2-methoxyethyl)-2-[[2-(2-methylpropylamino)-2-oxoethyl]amino]acetamide
CID 112683626
N-[2-[di(propan-2-yl)amino]ethyl]-2-(2-methoxyethylamino)acetamide
CID 79282466
2-(2-methoxyethylamino)-N-(3-methoxypropyl)acetamide;hydrochloride
CID 119672351
N-(2-methoxyethyl)-2-(2-propoxyethylamino)acetamide
CID 106452448
ethyl 2-[[2-(2-methoxyethylamino)acetyl]amino]acetate
CID 79282629
2-(1-aminocyclobutyl)-N-[2-(dimethylamino)-3-ethylpentyl]acetamide
CID 79854632
2-(butylamino)-N-(2-methoxyethyl)acetamide
CID 54815346

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-3-ethylpentyl]-2-(2-methoxyethylamino)acetamide?
The IUPAC name of N-[2-(dimethylamino)-3-ethylpentyl]-2-(2-methoxyethylamino)acetamide (CID 79280648) is N-[2-(dimethylamino)-3-ethylpentyl]-2-(2-methoxyethylamino)acetamide.
What is the SMILES notation for N-[2-(dimethylamino)-3-ethylpentyl]-2-(2-methoxyethylamino)acetamide?
The canonical SMILES for N-[2-(dimethylamino)-3-ethylpentyl]-2-(2-methoxyethylamino)acetamide is CCC(CC)C(CNC(=O)CNCCOC)N(C)C.
What is the InChIKey of N-[2-(dimethylamino)-3-ethylpentyl]-2-(2-methoxyethylamino)acetamide?
The InChIKey is UMSKXKQNRKFMFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31N3O2/c1-6-12(7-2)13(17(3)4)10-16-14(18)11-15-8-9-19-5/h12-13,15H,6-11H2,1-5H3,(H,16,18).
What are the key properties of N-[2-(dimethylamino)-3-ethylpentyl]-2-(2-methoxyethylamino)acetamide?
N-[2-(dimethylamino)-3-ethylpentyl]-2-(2-methoxyethylamino)acetamide has a molecular weight of 273.42 g/mol, XLogP of 0.70, 11 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-3-ethylpentyl]-2-(2-methoxyethylamino)acetamide is sourced from PubChem (CID 79280648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).