N-cyclobutyl-N-(2-hydroxyethyl)-2-methyl-2-piperazin-1-ylpropanamide

C14H27N3O2 — CID 102862098

IUPACN-cyclobutyl-N-(2-hydroxyethyl)-2-methyl-2-piperazin-1-ylpropanamide
SMILESCC(C)(C(=O)N(CCO)C1CCC1)N1CCNCC1
InChIInChI=1S/C14H27N3O2/c1-14(2,16-8-6-15-7-9-16)13(19)17(10-11-18)12-4-3-5-12/h12,15,18H,3-11H2,1-2H3
InChIKeyODUNFJSTWGGNPS-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.04
Rot. Bonds5

About N-cyclobutyl-N-(2-hydroxyethyl)-2-methyl-2-piperazin-1-ylpropanamide

N-cyclobutyl-N-(2-hydroxyethyl)-2-methyl-2-piperazin-1-ylpropanamide (PubChem CID 102862098) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is N-cyclobutyl-N-(2-hydroxyethyl)-2-methyl-2-piperazin-1-ylpropanamide.

Molecular Properties

Compound NameN-cyclobutyl-N-(2-hydroxyethyl)-2-methyl-2-piperazin-1-ylpropanamide
PubChem CID102862098
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC NameN-cyclobutyl-N-(2-hydroxyethyl)-2-methyl-2-piperazin-1-ylpropanamide
SMILESCC(C)(C(=O)N(CCO)C1CCC1)N1CCNCC1
InChIInChI=1S/C14H27N3O2/c1-14(2,16-8-6-15-7-9-16)13(19)17(10-11-18)12-4-3-5-12/h12,15,18H,3-11H2,1-2H3
InChIKeyODUNFJSTWGGNPS-UHFFFAOYSA-N
XLogP0.04
TPSA55.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-N-(2-hydroxyethyl)-2-methyl-2-piperazin-1-ylpropanamide?
The IUPAC name of N-cyclobutyl-N-(2-hydroxyethyl)-2-methyl-2-piperazin-1-ylpropanamide (CID 102862098) is N-cyclobutyl-N-(2-hydroxyethyl)-2-methyl-2-piperazin-1-ylpropanamide.
What is the SMILES notation for N-cyclobutyl-N-(2-hydroxyethyl)-2-methyl-2-piperazin-1-ylpropanamide?
The canonical SMILES for N-cyclobutyl-N-(2-hydroxyethyl)-2-methyl-2-piperazin-1-ylpropanamide is CC(C)(C(=O)N(CCO)C1CCC1)N1CCNCC1.
What is the InChIKey of N-cyclobutyl-N-(2-hydroxyethyl)-2-methyl-2-piperazin-1-ylpropanamide?
The InChIKey is ODUNFJSTWGGNPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-14(2,16-8-6-15-7-9-16)13(19)17(10-11-18)12-4-3-5-12/h12,15,18H,3-11H2,1-2H3.
What are the key properties of N-cyclobutyl-N-(2-hydroxyethyl)-2-methyl-2-piperazin-1-ylpropanamide?
N-cyclobutyl-N-(2-hydroxyethyl)-2-methyl-2-piperazin-1-ylpropanamide has a molecular weight of 269.39 g/mol, XLogP of 0.04, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-N-(2-hydroxyethyl)-2-methyl-2-piperazin-1-ylpropanamide is sourced from PubChem (CID 102862098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).