N-cyclohexyl-2-[2-(4,4-difluoropiperidine-1-carbonyl)morpholin-4-yl]acetamide

C18H29F2N3O3 — CID 163350883

IUPACN-cyclohexyl-2-[2-(4,4-difluoropiperidine-1-carbonyl)morpholin-4-yl]acetamide
SMILESO=C(CN1CCOC(C(=O)N2CCC(F)(F)CC2)C1)NC1CCCCC1
InChIInChI=1S/C18H29F2N3O3/c19-18(20)6-8-23(9-7-18)17(25)15-12-22(10-11-26-15)13-16(24)21-14-4-2-1-3-5-14/h14-15H,1-13H2,(H,21,24)
InChIKeyTWOFJJSWADBPFK-UHFFFAOYSA-N
MW373.44 g/mol
LogP1.39
Rot. Bonds4

About N-cyclohexyl-2-[2-(4,4-difluoropiperidine-1-carbonyl)morpholin-4-yl]acetamide

N-cyclohexyl-2-[2-(4,4-difluoropiperidine-1-carbonyl)morpholin-4-yl]acetamide (PubChem CID 163350883) has the molecular formula C18H29F2N3O3 and a molecular weight of 373.44 g/mol. Its IUPAC name is N-cyclohexyl-2-[2-(4,4-difluoropiperidine-1-carbonyl)morpholin-4-yl]acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[2-(4,4-difluoropiperidine-1-carbonyl)morpholin-4-yl]acetamide
PubChem CID163350883
Molecular FormulaC18H29F2N3O3
Molecular Weight373.44 g/mol
Exact Mass373.22
IUPAC NameN-cyclohexyl-2-[2-(4,4-difluoropiperidine-1-carbonyl)morpholin-4-yl]acetamide
SMILESO=C(CN1CCOC(C(=O)N2CCC(F)(F)CC2)C1)NC1CCCCC1
InChIInChI=1S/C18H29F2N3O3/c19-18(20)6-8-23(9-7-18)17(25)15-12-22(10-11-26-15)13-16(24)21-14-4-2-1-3-5-14/h14-15H,1-13H2,(H,21,24)
InChIKeyTWOFJJSWADBPFK-UHFFFAOYSA-N
XLogP1.39
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.44
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[2-(4,4-difluoropiperidine-1-carbonyl)morpholin-4-yl]acetamide?
The IUPAC name of N-cyclohexyl-2-[2-(4,4-difluoropiperidine-1-carbonyl)morpholin-4-yl]acetamide (CID 163350883) is N-cyclohexyl-2-[2-(4,4-difluoropiperidine-1-carbonyl)morpholin-4-yl]acetamide.
What is the SMILES notation for N-cyclohexyl-2-[2-(4,4-difluoropiperidine-1-carbonyl)morpholin-4-yl]acetamide?
The canonical SMILES for N-cyclohexyl-2-[2-(4,4-difluoropiperidine-1-carbonyl)morpholin-4-yl]acetamide is O=C(CN1CCOC(C(=O)N2CCC(F)(F)CC2)C1)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-[2-(4,4-difluoropiperidine-1-carbonyl)morpholin-4-yl]acetamide?
The InChIKey is TWOFJJSWADBPFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29F2N3O3/c19-18(20)6-8-23(9-7-18)17(25)15-12-22(10-11-26-15)13-16(24)21-14-4-2-1-3-5-14/h14-15H,1-13H2,(H,21,24).
What are the key properties of N-cyclohexyl-2-[2-(4,4-difluoropiperidine-1-carbonyl)morpholin-4-yl]acetamide?
N-cyclohexyl-2-[2-(4,4-difluoropiperidine-1-carbonyl)morpholin-4-yl]acetamide has a molecular weight of 373.44 g/mol, XLogP of 1.39, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[2-(4,4-difluoropiperidine-1-carbonyl)morpholin-4-yl]acetamide is sourced from PubChem (CID 163350883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).