4-(2-hydroxypropyl)-N-propan-2-ylpiperazine-1-carboxamide;hydrochloride

C11H24ClN3O2 — CID 71783481

IUPAC4-(2-hydroxypropyl)-N-propan-2-ylpiperazine-1-carboxamide;hydrochloride
SMILESCC(O)CN1CCN(C(=O)NC(C)C)CC1.Cl
InChIInChI=1S/C11H23N3O2.ClH/c1-9(2)12-11(16)14-6-4-13(5-7-14)8-10(3)15;/h9-10,15H,4-8H2,1-3H3,(H,12,16);1H
InChIKeyKHYXUZAOZJBCCD-UHFFFAOYSA-N
MW265.78 g/mol
LogP0.52
Rot. Bonds3

About 4-(2-hydroxypropyl)-N-propan-2-ylpiperazine-1-carboxamide;hydrochloride

4-(2-hydroxypropyl)-N-propan-2-ylpiperazine-1-carboxamide;hydrochloride (PubChem CID 71783481) has the molecular formula C11H24ClN3O2 and a molecular weight of 265.78 g/mol. Its IUPAC name is 4-(2-hydroxypropyl)-N-propan-2-ylpiperazine-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name4-(2-hydroxypropyl)-N-propan-2-ylpiperazine-1-carboxamide;hydrochloride
PubChem CID71783481
Molecular FormulaC11H24ClN3O2
Molecular Weight265.78 g/mol
Exact Mass265.16
IUPAC Name4-(2-hydroxypropyl)-N-propan-2-ylpiperazine-1-carboxamide;hydrochloride
SMILESCC(O)CN1CCN(C(=O)NC(C)C)CC1.Cl
InChIInChI=1S/C11H23N3O2.ClH/c1-9(2)12-11(16)14-6-4-13(5-7-14)8-10(3)15;/h9-10,15H,4-8H2,1-3H3,(H,12,16);1H
InChIKeyKHYXUZAOZJBCCD-UHFFFAOYSA-N
XLogP0.52
TPSA55.81 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.78
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-hydroxypropyl)-N-propan-2-ylpiperazine-1-carboxamide;hydrochloride?
The IUPAC name of 4-(2-hydroxypropyl)-N-propan-2-ylpiperazine-1-carboxamide;hydrochloride (CID 71783481) is 4-(2-hydroxypropyl)-N-propan-2-ylpiperazine-1-carboxamide;hydrochloride.
What is the SMILES notation for 4-(2-hydroxypropyl)-N-propan-2-ylpiperazine-1-carboxamide;hydrochloride?
The canonical SMILES for 4-(2-hydroxypropyl)-N-propan-2-ylpiperazine-1-carboxamide;hydrochloride is CC(O)CN1CCN(C(=O)NC(C)C)CC1.Cl.
What is the InChIKey of 4-(2-hydroxypropyl)-N-propan-2-ylpiperazine-1-carboxamide;hydrochloride?
The InChIKey is KHYXUZAOZJBCCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2.ClH/c1-9(2)12-11(16)14-6-4-13(5-7-14)8-10(3)15;/h9-10,15H,4-8H2,1-3H3,(H,12,16);1H.
What are the key properties of 4-(2-hydroxypropyl)-N-propan-2-ylpiperazine-1-carboxamide;hydrochloride?
4-(2-hydroxypropyl)-N-propan-2-ylpiperazine-1-carboxamide;hydrochloride has a molecular weight of 265.78 g/mol, XLogP of 0.52, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-hydroxypropyl)-N-propan-2-ylpiperazine-1-carboxamide;hydrochloride is sourced from PubChem (CID 71783481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).