4-[2-[1-[2-(4-propan-2-ylpiperazin-1-yl)propan-2-yl]piperidin-4-yl]propan-2-yl]morpholine

C22H44N4O — CID 131978342

IUPAC4-[2-[1-[2-(4-propan-2-ylpiperazin-1-yl)propan-2-yl]piperidin-4-yl]propan-2-yl]morpholine
SMILESCC(C)N1CCN(C(C)(C)N2CCC(C(C)(C)N3CCOCC3)CC2)CC1
InChIInChI=1S/C22H44N4O/c1-19(2)23-11-13-26(14-12-23)22(5,6)25-9-7-20(8-10-25)21(3,4)24-15-17-27-18-16-24/h19-20H,7-18H2,1-6H3
InChIKeyQVYIACDUYVXCHQ-UHFFFAOYSA-N
MW380.62 g/mol
LogP2.57
Rot. Bonds5

About 4-[2-[1-[2-(4-propan-2-ylpiperazin-1-yl)propan-2-yl]piperidin-4-yl]propan-2-yl]morpholine

4-[2-[1-[2-(4-propan-2-ylpiperazin-1-yl)propan-2-yl]piperidin-4-yl]propan-2-yl]morpholine (PubChem CID 131978342) has the molecular formula C22H44N4O and a molecular weight of 380.62 g/mol. Its IUPAC name is 4-[2-[1-[2-(4-propan-2-ylpiperazin-1-yl)propan-2-yl]piperidin-4-yl]propan-2-yl]morpholine.

Molecular Properties

Compound Name4-[2-[1-[2-(4-propan-2-ylpiperazin-1-yl)propan-2-yl]piperidin-4-yl]propan-2-yl]morpholine
PubChem CID131978342
Molecular FormulaC22H44N4O
Molecular Weight380.62 g/mol
Exact Mass380.35
IUPAC Name4-[2-[1-[2-(4-propan-2-ylpiperazin-1-yl)propan-2-yl]piperidin-4-yl]propan-2-yl]morpholine
SMILESCC(C)N1CCN(C(C)(C)N2CCC(C(C)(C)N3CCOCC3)CC2)CC1
InChIInChI=1S/C22H44N4O/c1-19(2)23-11-13-26(14-12-23)22(5,6)25-9-7-20(8-10-25)21(3,4)24-15-17-27-18-16-24/h19-20H,7-18H2,1-6H3
InChIKeyQVYIACDUYVXCHQ-UHFFFAOYSA-N
XLogP2.57
TPSA22.19 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.62
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[2-[1-[2-(4-propan-2-ylpiperazin-1-yl)propan-2-yl]piperidin-4-yl]propan-2-yl]morpholine?
The IUPAC name of 4-[2-[1-[2-(4-propan-2-ylpiperazin-1-yl)propan-2-yl]piperidin-4-yl]propan-2-yl]morpholine (CID 131978342) is 4-[2-[1-[2-(4-propan-2-ylpiperazin-1-yl)propan-2-yl]piperidin-4-yl]propan-2-yl]morpholine.
What is the SMILES notation for 4-[2-[1-[2-(4-propan-2-ylpiperazin-1-yl)propan-2-yl]piperidin-4-yl]propan-2-yl]morpholine?
The canonical SMILES for 4-[2-[1-[2-(4-propan-2-ylpiperazin-1-yl)propan-2-yl]piperidin-4-yl]propan-2-yl]morpholine is CC(C)N1CCN(C(C)(C)N2CCC(C(C)(C)N3CCOCC3)CC2)CC1.
What is the InChIKey of 4-[2-[1-[2-(4-propan-2-ylpiperazin-1-yl)propan-2-yl]piperidin-4-yl]propan-2-yl]morpholine?
The InChIKey is QVYIACDUYVXCHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H44N4O/c1-19(2)23-11-13-26(14-12-23)22(5,6)25-9-7-20(8-10-25)21(3,4)24-15-17-27-18-16-24/h19-20H,7-18H2,1-6H3.
What are the key properties of 4-[2-[1-[2-(4-propan-2-ylpiperazin-1-yl)propan-2-yl]piperidin-4-yl]propan-2-yl]morpholine?
4-[2-[1-[2-(4-propan-2-ylpiperazin-1-yl)propan-2-yl]piperidin-4-yl]propan-2-yl]morpholine has a molecular weight of 380.62 g/mol, XLogP of 2.57, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[1-[2-(4-propan-2-ylpiperazin-1-yl)propan-2-yl]piperidin-4-yl]propan-2-yl]morpholine is sourced from PubChem (CID 131978342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).