2-[methyl(piperidin-4-ylmethyl)amino]-N-(oxan-4-yl)acetamide

C14H27N3O2 — CID 79716602

IUPAC2-[methyl(piperidin-4-ylmethyl)amino]-N-(oxan-4-yl)acetamide
SMILESCN(CC(=O)NC1CCOCC1)CC1CCNCC1
InChIInChI=1S/C14H27N3O2/c1-17(10-12-2-6-15-7-3-12)11-14(18)16-13-4-8-19-9-5-13/h12-13,15H,2-11H2,1H3,(H,16,18)
InChIKeyNQSVVIMWPQBURD-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.21
Rot. Bonds5

About 2-[methyl(piperidin-4-ylmethyl)amino]-N-(oxan-4-yl)acetamide

2-[methyl(piperidin-4-ylmethyl)amino]-N-(oxan-4-yl)acetamide (PubChem CID 79716602) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 2-[methyl(piperidin-4-ylmethyl)amino]-N-(oxan-4-yl)acetamide.

Molecular Properties

Compound Name2-[methyl(piperidin-4-ylmethyl)amino]-N-(oxan-4-yl)acetamide
PubChem CID79716602
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name2-[methyl(piperidin-4-ylmethyl)amino]-N-(oxan-4-yl)acetamide
SMILESCN(CC(=O)NC1CCOCC1)CC1CCNCC1
InChIInChI=1S/C14H27N3O2/c1-17(10-12-2-6-15-7-3-12)11-14(18)16-13-4-8-19-9-5-13/h12-13,15H,2-11H2,1H3,(H,16,18)
InChIKeyNQSVVIMWPQBURD-UHFFFAOYSA-N
XLogP0.21
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-2-[methyl(piperidin-4-ylmethyl)amino]acetamide
CID 79717424
2-[methyl(2-piperidin-4-ylethyl)amino]-N-(oxan-4-yl)acetamide
CID 66272158
4-[methyl-[2-(oxan-4-ylamino)-2-oxoethyl]amino]butanoic acid
CID 63097843
2-[methyl(piperidin-4-ylmethyl)amino]-N-(oxolan-2-ylmethyl)acetamide
CID 79716446
N-cyclohexyl-2-[methyl(piperidin-3-ylmethyl)amino]acetamide
CID 106636311
4-[[2-[methyl(piperidin-4-ylmethyl)amino]acetyl]amino]butanoic acid
CID 79717421
2-[methyl(piperidin-4-ylmethyl)amino]-N-(2,4,6-trimethylphenyl)acetamide;hydrochloride
CID 119930334
2-[(3-amino-2-methyl-3-sulfanylidenepropyl)-methylamino]-N-(oxan-4-yl)acetamide
CID 55181499
N-cyclopropyl-N-methyl-2-[methyl(piperidin-4-ylmethyl)amino]acetamide
CID 79716361
2-[cyclopentylmethyl(methyl)amino]-N-(1-ethylpiperidin-4-yl)acetamide
CID 86868172
2-[methyl-[[(6S)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]amino]-N-(oxan-4-yl)acetamide
CID 129338575
N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylpiperidine-4-carboxamide
CID 43579064

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(piperidin-4-ylmethyl)amino]-N-(oxan-4-yl)acetamide?
The IUPAC name of 2-[methyl(piperidin-4-ylmethyl)amino]-N-(oxan-4-yl)acetamide (CID 79716602) is 2-[methyl(piperidin-4-ylmethyl)amino]-N-(oxan-4-yl)acetamide.
What is the SMILES notation for 2-[methyl(piperidin-4-ylmethyl)amino]-N-(oxan-4-yl)acetamide?
The canonical SMILES for 2-[methyl(piperidin-4-ylmethyl)amino]-N-(oxan-4-yl)acetamide is CN(CC(=O)NC1CCOCC1)CC1CCNCC1.
What is the InChIKey of 2-[methyl(piperidin-4-ylmethyl)amino]-N-(oxan-4-yl)acetamide?
The InChIKey is NQSVVIMWPQBURD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-17(10-12-2-6-15-7-3-12)11-14(18)16-13-4-8-19-9-5-13/h12-13,15H,2-11H2,1H3,(H,16,18).
What are the key properties of 2-[methyl(piperidin-4-ylmethyl)amino]-N-(oxan-4-yl)acetamide?
2-[methyl(piperidin-4-ylmethyl)amino]-N-(oxan-4-yl)acetamide has a molecular weight of 269.39 g/mol, XLogP of 0.21, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(piperidin-4-ylmethyl)amino]-N-(oxan-4-yl)acetamide is sourced from PubChem (CID 79716602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).