N-methyl-2-[4-[3-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]acetamide

C18H32N4O3 — CID 70787894

IUPACN-methyl-2-[4-[3-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]acetamide
SMILESCNC(=O)CN1CCC(N2CCCC(C(=O)N3CCOCC3)C2)CC1
InChIInChI=1S/C18H32N4O3/c1-19-17(23)14-20-7-4-16(5-8-20)22-6-2-3-15(13-22)18(24)21-9-11-25-12-10-21/h15-16H,2-14H2,1H3,(H,19,23)
InChIKeySKDLIDPESOUEPQ-UHFFFAOYSA-N
MW352.48 g/mol
LogP-0.23
Rot. Bonds4

About N-methyl-2-[4-[3-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]acetamide

N-methyl-2-[4-[3-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]acetamide (PubChem CID 70787894) has the molecular formula C18H32N4O3 and a molecular weight of 352.48 g/mol. Its IUPAC name is N-methyl-2-[4-[3-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-methyl-2-[4-[3-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]acetamide
PubChem CID70787894
Molecular FormulaC18H32N4O3
Molecular Weight352.48 g/mol
Exact Mass352.25
IUPAC NameN-methyl-2-[4-[3-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]acetamide
SMILESCNC(=O)CN1CCC(N2CCCC(C(=O)N3CCOCC3)C2)CC1
InChIInChI=1S/C18H32N4O3/c1-19-17(23)14-20-7-4-16(5-8-20)22-6-2-3-15(13-22)18(24)21-9-11-25-12-10-21/h15-16H,2-14H2,1H3,(H,19,23)
InChIKeySKDLIDPESOUEPQ-UHFFFAOYSA-N
XLogP-0.23
TPSA65.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[4-[3-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]acetamide?
The IUPAC name of N-methyl-2-[4-[3-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]acetamide (CID 70787894) is N-methyl-2-[4-[3-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]acetamide.
What is the SMILES notation for N-methyl-2-[4-[3-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]acetamide?
The canonical SMILES for N-methyl-2-[4-[3-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]acetamide is CNC(=O)CN1CCC(N2CCCC(C(=O)N3CCOCC3)C2)CC1.
What is the InChIKey of N-methyl-2-[4-[3-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]acetamide?
The InChIKey is SKDLIDPESOUEPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N4O3/c1-19-17(23)14-20-7-4-16(5-8-20)22-6-2-3-15(13-22)18(24)21-9-11-25-12-10-21/h15-16H,2-14H2,1H3,(H,19,23).
What are the key properties of N-methyl-2-[4-[3-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]acetamide?
N-methyl-2-[4-[3-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]acetamide has a molecular weight of 352.48 g/mol, XLogP of -0.23, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[4-[3-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]acetamide is sourced from PubChem (CID 70787894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).