4-amino-N-propan-2-yl-3-(4-propan-2-ylpiperazin-1-yl)butanamide

C14H30N4O — CID 66430565

IUPAC4-amino-N-propan-2-yl-3-(4-propan-2-ylpiperazin-1-yl)butanamide
SMILESCC(C)NC(=O)CC(CN)N1CCN(C(C)C)CC1
InChIInChI=1S/C14H30N4O/c1-11(2)16-14(19)9-13(10-15)18-7-5-17(6-8-18)12(3)4/h11-13H,5-10,15H2,1-4H3,(H,16,19)
InChIKeyTZLTZPYLYUPOBC-UHFFFAOYSA-N
MW270.42 g/mol
LogP0.25
Rot. Bonds6

About 4-amino-N-propan-2-yl-3-(4-propan-2-ylpiperazin-1-yl)butanamide

4-amino-N-propan-2-yl-3-(4-propan-2-ylpiperazin-1-yl)butanamide (PubChem CID 66430565) has the molecular formula C14H30N4O and a molecular weight of 270.42 g/mol. Its IUPAC name is 4-amino-N-propan-2-yl-3-(4-propan-2-ylpiperazin-1-yl)butanamide.

Molecular Properties

Compound Name4-amino-N-propan-2-yl-3-(4-propan-2-ylpiperazin-1-yl)butanamide
PubChem CID66430565
Molecular FormulaC14H30N4O
Molecular Weight270.42 g/mol
Exact Mass270.24
IUPAC Name4-amino-N-propan-2-yl-3-(4-propan-2-ylpiperazin-1-yl)butanamide
SMILESCC(C)NC(=O)CC(CN)N1CCN(C(C)C)CC1
InChIInChI=1S/C14H30N4O/c1-11(2)16-14(19)9-13(10-15)18-7-5-17(6-8-18)12(3)4/h11-13H,5-10,15H2,1-4H3,(H,16,19)
InChIKeyTZLTZPYLYUPOBC-UHFFFAOYSA-N
XLogP0.25
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-propan-2-yl-3-(4-propan-2-ylpiperazin-1-yl)butanamide?
The IUPAC name of 4-amino-N-propan-2-yl-3-(4-propan-2-ylpiperazin-1-yl)butanamide (CID 66430565) is 4-amino-N-propan-2-yl-3-(4-propan-2-ylpiperazin-1-yl)butanamide.
What is the SMILES notation for 4-amino-N-propan-2-yl-3-(4-propan-2-ylpiperazin-1-yl)butanamide?
The canonical SMILES for 4-amino-N-propan-2-yl-3-(4-propan-2-ylpiperazin-1-yl)butanamide is CC(C)NC(=O)CC(CN)N1CCN(C(C)C)CC1.
What is the InChIKey of 4-amino-N-propan-2-yl-3-(4-propan-2-ylpiperazin-1-yl)butanamide?
The InChIKey is TZLTZPYLYUPOBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N4O/c1-11(2)16-14(19)9-13(10-15)18-7-5-17(6-8-18)12(3)4/h11-13H,5-10,15H2,1-4H3,(H,16,19).
What are the key properties of 4-amino-N-propan-2-yl-3-(4-propan-2-ylpiperazin-1-yl)butanamide?
4-amino-N-propan-2-yl-3-(4-propan-2-ylpiperazin-1-yl)butanamide has a molecular weight of 270.42 g/mol, XLogP of 0.25, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-propan-2-yl-3-(4-propan-2-ylpiperazin-1-yl)butanamide is sourced from PubChem (CID 66430565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).