4-amino-3-methoxy-N,N-dipropylbutanamide

C11H24N2O2 — CID 103154067

IUPAC4-amino-3-methoxy-N,N-dipropylbutanamide
SMILESCCCN(CCC)C(=O)CC(CN)OC
InChIInChI=1S/C11H24N2O2/c1-4-6-13(7-5-2)11(14)8-10(9-12)15-3/h10H,4-9,12H2,1-3H3
InChIKeyMZCOBNUNAPIGEA-UHFFFAOYSA-N
MW216.32 g/mol
LogP1.00
Rot. Bonds8

About 4-amino-3-methoxy-N,N-dipropylbutanamide

4-amino-3-methoxy-N,N-dipropylbutanamide (PubChem CID 103154067) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 4-amino-3-methoxy-N,N-dipropylbutanamide.

Molecular Properties

Compound Name4-amino-3-methoxy-N,N-dipropylbutanamide
PubChem CID103154067
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name4-amino-3-methoxy-N,N-dipropylbutanamide
SMILESCCCN(CCC)C(=O)CC(CN)OC
InChIInChI=1S/C11H24N2O2/c1-4-6-13(7-5-2)11(14)8-10(9-12)15-3/h10H,4-9,12H2,1-3H3
InChIKeyMZCOBNUNAPIGEA-UHFFFAOYSA-N
XLogP1.00
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-3-methoxy-N,N-dipropylbutanamide?
The IUPAC name of 4-amino-3-methoxy-N,N-dipropylbutanamide (CID 103154067) is 4-amino-3-methoxy-N,N-dipropylbutanamide.
What is the SMILES notation for 4-amino-3-methoxy-N,N-dipropylbutanamide?
The canonical SMILES for 4-amino-3-methoxy-N,N-dipropylbutanamide is CCCN(CCC)C(=O)CC(CN)OC.
What is the InChIKey of 4-amino-3-methoxy-N,N-dipropylbutanamide?
The InChIKey is MZCOBNUNAPIGEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-4-6-13(7-5-2)11(14)8-10(9-12)15-3/h10H,4-9,12H2,1-3H3.
What are the key properties of 4-amino-3-methoxy-N,N-dipropylbutanamide?
4-amino-3-methoxy-N,N-dipropylbutanamide has a molecular weight of 216.32 g/mol, XLogP of 1.00, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-methoxy-N,N-dipropylbutanamide is sourced from PubChem (CID 103154067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).