4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide

C13H24N2O2 — CID 120590887

IUPAC4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide
SMILESCOC(CN)CC(=O)N(C)C(C1CC1)C1CC1
InChIInChI=1S/C13H24N2O2/c1-15(12(16)7-11(8-14)17-2)13(9-3-4-9)10-5-6-10/h9-11,13H,3-8,14H2,1-2H3
InChIKeyXGSXSBRJQJVIFF-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.00
Rot. Bonds7

About 4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide

4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide (PubChem CID 120590887) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide.

Molecular Properties

Compound Name4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide
PubChem CID120590887
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide
SMILESCOC(CN)CC(=O)N(C)C(C1CC1)C1CC1
InChIInChI=1S/C13H24N2O2/c1-15(12(16)7-11(8-14)17-2)13(9-3-4-9)10-5-6-10/h9-11,13H,3-8,14H2,1-2H3
InChIKeyXGSXSBRJQJVIFF-UHFFFAOYSA-N
XLogP1.00
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide;hydrochloride
CID 120590886
4-amino-N-cyclooctyl-3-methoxy-N-methylbutanamide
CID 120591072
4-amino-3-methoxy-N-(1-methoxypropan-2-yl)-N-methylbutanamide
CID 103155184
4-amino-N-cyclopropyl-N-(2-hydroxyethyl)-3-methoxybutanamide
CID 103154406
4-amino-N-(dicyclopropylmethyl)-3-methoxybutanamide
CID 103155504
4-amino-N-(2-cyclohexylethyl)-3-methoxy-N-methylbutanamide;hydrochloride
CID 120591214
4-amino-N-cyclopropyl-N-(4-ethylcyclohexyl)-3-methoxybutanamide
CID 120589287
4-amino-3-methoxy-N-methyl-N-[2-(oxan-4-yl)ethyl]butanamide
CID 120593000
3-amino-N-cyclobutyl-2-methoxy-N-methylpropanamide
CID 106113872
4-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-3-methoxy-N-methylbutanamide
CID 103155894
N-(dicyclopropylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride
CID 119760613
2-[(4-amino-3-methoxybutanoyl)amino]-2-cyclopropylacetic acid
CID 103155791

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide?
The IUPAC name of 4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide (CID 120590887) is 4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide.
What is the SMILES notation for 4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide?
The canonical SMILES for 4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide is COC(CN)CC(=O)N(C)C(C1CC1)C1CC1.
What is the InChIKey of 4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide?
The InChIKey is XGSXSBRJQJVIFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-15(12(16)7-11(8-14)17-2)13(9-3-4-9)10-5-6-10/h9-11,13H,3-8,14H2,1-2H3.
What are the key properties of 4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide?
4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide has a molecular weight of 240.35 g/mol, XLogP of 1.00, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide is sourced from PubChem (CID 120590887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).