N-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-N-ethyl-2-morpholin-4-ylacetamide

C23H35N3O3 — CID 155514975

IUPACN-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-N-ethyl-2-morpholin-4-ylacetamide
SMILESCCN(C(=O)CN1CCOCC1)c1ccc(OC2CCN(C3CCC3)CC2)cc1
InChIInChI=1S/C23H35N3O3/c1-2-26(23(27)18-24-14-16-28-17-15-24)20-6-8-21(9-7-20)29-22-10-12-25(13-11-22)19-4-3-5-19/h6-9,19,22H,2-5,10-18H2,1H3
InChIKeyJRAULUZYXCYHLC-UHFFFAOYSA-N
MW401.55 g/mol
LogP2.77
Rot. Bonds7

About N-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-N-ethyl-2-morpholin-4-ylacetamide

N-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-N-ethyl-2-morpholin-4-ylacetamide (PubChem CID 155514975) has the molecular formula C23H35N3O3 and a molecular weight of 401.55 g/mol. Its IUPAC name is N-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-N-ethyl-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-N-ethyl-2-morpholin-4-ylacetamide
PubChem CID155514975
Molecular FormulaC23H35N3O3
Molecular Weight401.55 g/mol
Exact Mass401.27
IUPAC NameN-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-N-ethyl-2-morpholin-4-ylacetamide
SMILESCCN(C(=O)CN1CCOCC1)c1ccc(OC2CCN(C3CCC3)CC2)cc1
InChIInChI=1S/C23H35N3O3/c1-2-26(23(27)18-24-14-16-28-17-15-24)20-6-8-21(9-7-20)29-22-10-12-25(13-11-22)19-4-3-5-19/h6-9,19,22H,2-5,10-18H2,1H3
InChIKeyJRAULUZYXCYHLC-UHFFFAOYSA-N
XLogP2.77
TPSA45.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.55
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-N-ethyl-2-morpholin-4-ylacetamide?
The IUPAC name of N-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-N-ethyl-2-morpholin-4-ylacetamide (CID 155514975) is N-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-N-ethyl-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-N-ethyl-2-morpholin-4-ylacetamide?
The canonical SMILES for N-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-N-ethyl-2-morpholin-4-ylacetamide is CCN(C(=O)CN1CCOCC1)c1ccc(OC2CCN(C3CCC3)CC2)cc1.
What is the InChIKey of N-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-N-ethyl-2-morpholin-4-ylacetamide?
The InChIKey is JRAULUZYXCYHLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H35N3O3/c1-2-26(23(27)18-24-14-16-28-17-15-24)20-6-8-21(9-7-20)29-22-10-12-25(13-11-22)19-4-3-5-19/h6-9,19,22H,2-5,10-18H2,1H3.
What are the key properties of N-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-N-ethyl-2-morpholin-4-ylacetamide?
N-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-N-ethyl-2-morpholin-4-ylacetamide has a molecular weight of 401.55 g/mol, XLogP of 2.77, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-N-ethyl-2-morpholin-4-ylacetamide is sourced from PubChem (CID 155514975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).