4-[1-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]ethyl]morpholine

C15H26N4O — CID 70771790

IUPAC4-[1-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]ethyl]morpholine
SMILESCC(C1CCN(Cc2ncc[nH]2)CC1)N1CCOCC1
InChIInChI=1S/C15H26N4O/c1-13(19-8-10-20-11-9-19)14-2-6-18(7-3-14)12-15-16-4-5-17-15/h4-5,13-14H,2-3,6-12H2,1H3,(H,16,17)
InChIKeySXXZNGRNXDTNAN-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.34
Rot. Bonds4

About 4-[1-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]ethyl]morpholine

4-[1-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]ethyl]morpholine (PubChem CID 70771790) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 4-[1-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]ethyl]morpholine.

Molecular Properties

Compound Name4-[1-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]ethyl]morpholine
PubChem CID70771790
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name4-[1-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]ethyl]morpholine
SMILESCC(C1CCN(Cc2ncc[nH]2)CC1)N1CCOCC1
InChIInChI=1S/C15H26N4O/c1-13(19-8-10-20-11-9-19)14-2-6-18(7-3-14)12-15-16-4-5-17-15/h4-5,13-14H,2-3,6-12H2,1H3,(H,16,17)
InChIKeySXXZNGRNXDTNAN-UHFFFAOYSA-N
XLogP1.34
TPSA44.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[1-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]ethyl]morpholine?
The IUPAC name of 4-[1-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]ethyl]morpholine (CID 70771790) is 4-[1-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]ethyl]morpholine.
What is the SMILES notation for 4-[1-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]ethyl]morpholine?
The canonical SMILES for 4-[1-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]ethyl]morpholine is CC(C1CCN(Cc2ncc[nH]2)CC1)N1CCOCC1.
What is the InChIKey of 4-[1-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]ethyl]morpholine?
The InChIKey is SXXZNGRNXDTNAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-13(19-8-10-20-11-9-19)14-2-6-18(7-3-14)12-15-16-4-5-17-15/h4-5,13-14H,2-3,6-12H2,1H3,(H,16,17).
What are the key properties of 4-[1-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]ethyl]morpholine?
4-[1-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]ethyl]morpholine has a molecular weight of 278.40 g/mol, XLogP of 1.34, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]ethyl]morpholine is sourced from PubChem (CID 70771790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).