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

C13H25ClN2O2 — CID 120590886

IUPAC4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide;hydrochloride
SMILESCOC(CN)CC(=O)N(C)C(C1CC1)C1CC1.Cl
InChIInChI=1S/C13H24N2O2.ClH/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;1H
InChIKeyZERJTNFKNCDJNU-UHFFFAOYSA-N
MW276.81 g/mol
LogP1.42
Rot. Bonds7

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

4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide;hydrochloride (PubChem CID 120590886) has the molecular formula C13H25ClN2O2 and a molecular weight of 276.81 g/mol. Its IUPAC name is 4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide;hydrochloride.

Molecular Properties

Compound Name4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide;hydrochloride
PubChem CID120590886
Molecular FormulaC13H25ClN2O2
Molecular Weight276.81 g/mol
Exact Mass276.16
IUPAC Name4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide;hydrochloride
SMILESCOC(CN)CC(=O)N(C)C(C1CC1)C1CC1.Cl
InChIInChI=1S/C13H24N2O2.ClH/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;1H
InChIKeyZERJTNFKNCDJNU-UHFFFAOYSA-N
XLogP1.42
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.81
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide
CID 120590887
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-(2-cyclohexylethyl)-3-methoxy-N-methylbutanamide;hydrochloride
CID 120591214
3-amino-N-cyclobutyl-2-methoxy-N-methylpropanamide
CID 106113872
4-amino-N-cyclopropyl-N-(2-hydroxyethyl)-3-methoxybutanamide
CID 103154406
4-amino-N-(dicyclopropylmethyl)-3-methoxybutanamide
CID 103155504
N-(dicyclopropylmethyl)-N-methyl-3-piperidin-4-ylbutanamide;hydrochloride
CID 119760613
4-amino-N-[bis(4-chlorophenyl)methyl]-3-methoxy-N-methylbutanamide;hydrochloride
CID 120593768
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
4-amino-3-methoxy-N,N-bis(2-methoxyethyl)butanamide;hydrochloride
CID 120586450

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide;hydrochloride?
The IUPAC name of 4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide;hydrochloride (CID 120590886) is 4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide;hydrochloride.
What is the SMILES notation for 4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide;hydrochloride?
The canonical SMILES for 4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide;hydrochloride is COC(CN)CC(=O)N(C)C(C1CC1)C1CC1.Cl.
What is the InChIKey of 4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide;hydrochloride?
The InChIKey is ZERJTNFKNCDJNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2.ClH/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;1H.
What are the key properties of 4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide;hydrochloride?
4-amino-N-(dicyclopropylmethyl)-3-methoxy-N-methylbutanamide;hydrochloride has a molecular weight of 276.81 g/mol, XLogP of 1.42, 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;hydrochloride is sourced from PubChem (CID 120590886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).