N-[[1-(4-methylpiperidine-1-carbonyl)piperidin-4-yl]methyl]acetamide

C15H27N3O2 — CID 102736162

IUPACN-[[1-(4-methylpiperidine-1-carbonyl)piperidin-4-yl]methyl]acetamide
SMILESCC(=O)NCC1CCN(C(=O)N2CCC(C)CC2)CC1
InChIInChI=1S/C15H27N3O2/c1-12-3-7-17(8-4-12)15(20)18-9-5-14(6-10-18)11-16-13(2)19/h12,14H,3-11H2,1-2H3,(H,16,19)
InChIKeyHDJCGYQLQKHISD-UHFFFAOYSA-N
MW281.40 g/mol
LogP1.69
Rot. Bonds2

About N-[[1-(4-methylpiperidine-1-carbonyl)piperidin-4-yl]methyl]acetamide

N-[[1-(4-methylpiperidine-1-carbonyl)piperidin-4-yl]methyl]acetamide (PubChem CID 102736162) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is N-[[1-(4-methylpiperidine-1-carbonyl)piperidin-4-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[1-(4-methylpiperidine-1-carbonyl)piperidin-4-yl]methyl]acetamide
PubChem CID102736162
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC NameN-[[1-(4-methylpiperidine-1-carbonyl)piperidin-4-yl]methyl]acetamide
SMILESCC(=O)NCC1CCN(C(=O)N2CCC(C)CC2)CC1
InChIInChI=1S/C15H27N3O2/c1-12-3-7-17(8-4-12)15(20)18-9-5-14(6-10-18)11-16-13(2)19/h12,14H,3-11H2,1-2H3,(H,16,19)
InChIKeyHDJCGYQLQKHISD-UHFFFAOYSA-N
XLogP1.69
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(4-methylpiperidine-1-carbonyl)piperidin-4-yl]methyl]acetamide?
The IUPAC name of N-[[1-(4-methylpiperidine-1-carbonyl)piperidin-4-yl]methyl]acetamide (CID 102736162) is N-[[1-(4-methylpiperidine-1-carbonyl)piperidin-4-yl]methyl]acetamide.
What is the SMILES notation for N-[[1-(4-methylpiperidine-1-carbonyl)piperidin-4-yl]methyl]acetamide?
The canonical SMILES for N-[[1-(4-methylpiperidine-1-carbonyl)piperidin-4-yl]methyl]acetamide is CC(=O)NCC1CCN(C(=O)N2CCC(C)CC2)CC1.
What is the InChIKey of N-[[1-(4-methylpiperidine-1-carbonyl)piperidin-4-yl]methyl]acetamide?
The InChIKey is HDJCGYQLQKHISD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-12-3-7-17(8-4-12)15(20)18-9-5-14(6-10-18)11-16-13(2)19/h12,14H,3-11H2,1-2H3,(H,16,19).
What are the key properties of N-[[1-(4-methylpiperidine-1-carbonyl)piperidin-4-yl]methyl]acetamide?
N-[[1-(4-methylpiperidine-1-carbonyl)piperidin-4-yl]methyl]acetamide has a molecular weight of 281.40 g/mol, XLogP of 1.69, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(4-methylpiperidine-1-carbonyl)piperidin-4-yl]methyl]acetamide is sourced from PubChem (CID 102736162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).