N-butan-2-yl-3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]propanamide

C15H30N2O2 — CID 64851731

IUPACN-butan-2-yl-3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]propanamide
SMILESCCOC1CC(NCCC(=O)NC(C)CC)C1(C)C
InChIInChI=1S/C15H30N2O2/c1-6-11(3)17-14(18)8-9-16-12-10-13(19-7-2)15(12,4)5/h11-13,16H,6-10H2,1-5H3,(H,17,18)
InChIKeyFFGZSKYKIJXJOH-UHFFFAOYSA-N
MW270.42 g/mol
LogP2.08
Rot. Bonds8

About N-butan-2-yl-3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]propanamide

N-butan-2-yl-3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]propanamide (PubChem CID 64851731) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is N-butan-2-yl-3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]propanamide.

Molecular Properties

Compound NameN-butan-2-yl-3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]propanamide
PubChem CID64851731
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC NameN-butan-2-yl-3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]propanamide
SMILESCCOC1CC(NCCC(=O)NC(C)CC)C1(C)C
InChIInChI=1S/C15H30N2O2/c1-6-11(3)17-14(18)8-9-16-12-10-13(19-7-2)15(12,4)5/h11-13,16H,6-10H2,1-5H3,(H,17,18)
InChIKeyFFGZSKYKIJXJOH-UHFFFAOYSA-N
XLogP2.08
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]propanamide?
The IUPAC name of N-butan-2-yl-3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]propanamide (CID 64851731) is N-butan-2-yl-3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]propanamide.
What is the SMILES notation for N-butan-2-yl-3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]propanamide?
The canonical SMILES for N-butan-2-yl-3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]propanamide is CCOC1CC(NCCC(=O)NC(C)CC)C1(C)C.
What is the InChIKey of N-butan-2-yl-3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]propanamide?
The InChIKey is FFGZSKYKIJXJOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-6-11(3)17-14(18)8-9-16-12-10-13(19-7-2)15(12,4)5/h11-13,16H,6-10H2,1-5H3,(H,17,18).
What are the key properties of N-butan-2-yl-3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]propanamide?
N-butan-2-yl-3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]propanamide has a molecular weight of 270.42 g/mol, XLogP of 2.08, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]propanamide is sourced from PubChem (CID 64851731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).