(2R)-4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2-propan-2-ylpiperazine

C14H30N2O — CID 124873078

IUPAC(2R)-4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2-propan-2-ylpiperazine
SMILESCC(C)[C@@H]1CN(C)CCN1CCOC(C)(C)C
InChIInChI=1S/C14H30N2O/c1-12(2)13-11-15(6)7-8-16(13)9-10-17-14(3,4)5/h12-13H,7-11H2,1-6H3/t13-/m0/s1
InChIKeyNGWLQDLHNREBRN-ZDUSSCGKSA-N
MW242.41 g/mol
LogP2.07
Rot. Bonds4

About (2R)-4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2-propan-2-ylpiperazine

(2R)-4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2-propan-2-ylpiperazine (PubChem CID 124873078) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is (2R)-4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name(2R)-4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2-propan-2-ylpiperazine
PubChem CID124873078
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name(2R)-4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2-propan-2-ylpiperazine
SMILESCC(C)[C@@H]1CN(C)CCN1CCOC(C)(C)C
InChIInChI=1S/C14H30N2O/c1-12(2)13-11-15(6)7-8-16(13)9-10-17-14(3,4)5/h12-13H,7-11H2,1-6H3/t13-/m0/s1
InChIKeyNGWLQDLHNREBRN-ZDUSSCGKSA-N
XLogP2.07
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2-propan-2-ylpiperazine?
The IUPAC name of (2R)-4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2-propan-2-ylpiperazine (CID 124873078) is (2R)-4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2-propan-2-ylpiperazine.
What is the SMILES notation for (2R)-4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2-propan-2-ylpiperazine?
The canonical SMILES for (2R)-4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2-propan-2-ylpiperazine is CC(C)[C@@H]1CN(C)CCN1CCOC(C)(C)C.
What is the InChIKey of (2R)-4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2-propan-2-ylpiperazine?
The InChIKey is NGWLQDLHNREBRN-ZDUSSCGKSA-N. The full InChI is InChI=1S/C14H30N2O/c1-12(2)13-11-15(6)7-8-16(13)9-10-17-14(3,4)5/h12-13H,7-11H2,1-6H3/t13-/m0/s1.
What are the key properties of (2R)-4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2-propan-2-ylpiperazine?
(2R)-4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2-propan-2-ylpiperazine has a molecular weight of 242.41 g/mol, XLogP of 2.07, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2-propan-2-ylpiperazine is sourced from PubChem (CID 124873078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).