N-ethyl-4-(2-hydroxypropyl)piperazine-1-carboxamide

C10H21N3O2 — CID 71783484

IUPACN-ethyl-4-(2-hydroxypropyl)piperazine-1-carboxamide
SMILESCCNC(=O)N1CCN(CC(C)O)CC1
InChIInChI=1S/C10H21N3O2/c1-3-11-10(15)13-6-4-12(5-7-13)8-9(2)14/h9,14H,3-8H2,1-2H3,(H,11,15)
InChIKeyDJPAAWDCGYYRFV-UHFFFAOYSA-N
MW215.30 g/mol
LogP-0.29
Rot. Bonds3

About N-ethyl-4-(2-hydroxypropyl)piperazine-1-carboxamide

N-ethyl-4-(2-hydroxypropyl)piperazine-1-carboxamide (PubChem CID 71783484) has the molecular formula C10H21N3O2 and a molecular weight of 215.30 g/mol. Its IUPAC name is N-ethyl-4-(2-hydroxypropyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-(2-hydroxypropyl)piperazine-1-carboxamide
PubChem CID71783484
Molecular FormulaC10H21N3O2
Molecular Weight215.30 g/mol
Exact Mass215.16
IUPAC NameN-ethyl-4-(2-hydroxypropyl)piperazine-1-carboxamide
SMILESCCNC(=O)N1CCN(CC(C)O)CC1
InChIInChI=1S/C10H21N3O2/c1-3-11-10(15)13-6-4-12(5-7-13)8-9(2)14/h9,14H,3-8H2,1-2H3,(H,11,15)
InChIKeyDJPAAWDCGYYRFV-UHFFFAOYSA-N
XLogP-0.29
TPSA55.81 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(2-hydroxypropyl)piperazine-1-carboxamide?
The IUPAC name of N-ethyl-4-(2-hydroxypropyl)piperazine-1-carboxamide (CID 71783484) is N-ethyl-4-(2-hydroxypropyl)piperazine-1-carboxamide.
What is the SMILES notation for N-ethyl-4-(2-hydroxypropyl)piperazine-1-carboxamide?
The canonical SMILES for N-ethyl-4-(2-hydroxypropyl)piperazine-1-carboxamide is CCNC(=O)N1CCN(CC(C)O)CC1.
What is the InChIKey of N-ethyl-4-(2-hydroxypropyl)piperazine-1-carboxamide?
The InChIKey is DJPAAWDCGYYRFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O2/c1-3-11-10(15)13-6-4-12(5-7-13)8-9(2)14/h9,14H,3-8H2,1-2H3,(H,11,15).
What are the key properties of N-ethyl-4-(2-hydroxypropyl)piperazine-1-carboxamide?
N-ethyl-4-(2-hydroxypropyl)piperazine-1-carboxamide has a molecular weight of 215.30 g/mol, XLogP of -0.29, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(2-hydroxypropyl)piperazine-1-carboxamide is sourced from PubChem (CID 71783484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).