4-amino-3-methoxy-N,N-bis(2-methoxyethyl)butanamide;hydrochloride

C11H25ClN2O4 — CID 120586450

IUPAC4-amino-3-methoxy-N,N-bis(2-methoxyethyl)butanamide;hydrochloride
SMILESCOCCN(CCOC)C(=O)CC(CN)OC.Cl
InChIInChI=1S/C11H24N2O4.ClH/c1-15-6-4-13(5-7-16-2)11(14)8-10(9-12)17-3;/h10H,4-9,12H2,1-3H3;1H
InChIKeyBOUYEZXLMAEFEC-UHFFFAOYSA-N
MW284.78 g/mol
LogP-0.11
Rot. Bonds10

About 4-amino-3-methoxy-N,N-bis(2-methoxyethyl)butanamide;hydrochloride

4-amino-3-methoxy-N,N-bis(2-methoxyethyl)butanamide;hydrochloride (PubChem CID 120586450) has the molecular formula C11H25ClN2O4 and a molecular weight of 284.78 g/mol. Its IUPAC name is 4-amino-3-methoxy-N,N-bis(2-methoxyethyl)butanamide;hydrochloride.

Molecular Properties

Compound Name4-amino-3-methoxy-N,N-bis(2-methoxyethyl)butanamide;hydrochloride
PubChem CID120586450
Molecular FormulaC11H25ClN2O4
Molecular Weight284.78 g/mol
Exact Mass284.15
IUPAC Name4-amino-3-methoxy-N,N-bis(2-methoxyethyl)butanamide;hydrochloride
SMILESCOCCN(CCOC)C(=O)CC(CN)OC.Cl
InChIInChI=1S/C11H24N2O4.ClH/c1-15-6-4-13(5-7-16-2)11(14)8-10(9-12)17-3;/h10H,4-9,12H2,1-3H3;1H
InChIKeyBOUYEZXLMAEFEC-UHFFFAOYSA-N
XLogP-0.11
TPSA74.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.78
LogP ≤ 5-0.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-N-(2,2-difluoroethyl)-3-methoxy-N-(2-methoxyethyl)butanamide;hydrochloride
CID 120591334
4-amino-N,N-dibutyl-3-methoxybutanamide
CID 103154284
4-amino-N-(2,2-difluoroethyl)-3-methoxy-N-propylbutanamide;hydrochloride
CID 120591084
4-amino-3-methoxy-N-(1-methoxypropan-2-yl)-N-methylbutanamide
CID 103155184
4-amino-N-(2-amino-2-oxoethyl)-N-ethyl-3-methoxybutanamide
CID 103156901
methyl 2-[(4-amino-3-methoxybutanoyl)-propylamino]acetate
CID 103155156
4-amino-N-butyl-3-methoxy-N-(2,2,2-trifluoroethyl)butanamide;hydrochloride
CID 120589296
4-amino-N-(2-hydroxyethyl)-3-methoxy-N-(2,2,2-trifluoroethyl)butanamide
CID 103155309
4-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-methoxybutanamide
CID 103156201
4-amino-N-benzyl-3-methoxy-N-(2-phenylethyl)butanamide;hydrochloride
CID 120586577
4-amino-N-ethyl-3-methoxy-N-(2-phenylethyl)butanamide;hydrochloride
CID 120589443
4-amino-N-benzyl-3-methoxy-N-propylbutanamide;hydrochloride
CID 120586847

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-methoxy-N,N-bis(2-methoxyethyl)butanamide;hydrochloride?
The IUPAC name of 4-amino-3-methoxy-N,N-bis(2-methoxyethyl)butanamide;hydrochloride (CID 120586450) is 4-amino-3-methoxy-N,N-bis(2-methoxyethyl)butanamide;hydrochloride.
What is the SMILES notation for 4-amino-3-methoxy-N,N-bis(2-methoxyethyl)butanamide;hydrochloride?
The canonical SMILES for 4-amino-3-methoxy-N,N-bis(2-methoxyethyl)butanamide;hydrochloride is COCCN(CCOC)C(=O)CC(CN)OC.Cl.
What is the InChIKey of 4-amino-3-methoxy-N,N-bis(2-methoxyethyl)butanamide;hydrochloride?
The InChIKey is BOUYEZXLMAEFEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O4.ClH/c1-15-6-4-13(5-7-16-2)11(14)8-10(9-12)17-3;/h10H,4-9,12H2,1-3H3;1H.
What are the key properties of 4-amino-3-methoxy-N,N-bis(2-methoxyethyl)butanamide;hydrochloride?
4-amino-3-methoxy-N,N-bis(2-methoxyethyl)butanamide;hydrochloride has a molecular weight of 284.78 g/mol, XLogP of -0.11, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-methoxy-N,N-bis(2-methoxyethyl)butanamide;hydrochloride is sourced from PubChem (CID 120586450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).