1-[2-[piperidin-3-ylmethyl(propyl)amino]acetyl]imidazolidin-2-one

C14H26N4O2 — CID 106640737

IUPAC1-[2-[piperidin-3-ylmethyl(propyl)amino]acetyl]imidazolidin-2-one
SMILESCCCN(CC(=O)N1CCNC1=O)CC1CCCNC1
InChIInChI=1S/C14H26N4O2/c1-2-7-17(10-12-4-3-5-15-9-12)11-13(19)18-8-6-16-14(18)20/h12,15H,2-11H2,1H3,(H,16,20)
InChIKeyMTDAMHUPRNMSMK-UHFFFAOYSA-N
MW282.39 g/mol
LogP0.25
Rot. Bonds6

About 1-[2-[piperidin-3-ylmethyl(propyl)amino]acetyl]imidazolidin-2-one

1-[2-[piperidin-3-ylmethyl(propyl)amino]acetyl]imidazolidin-2-one (PubChem CID 106640737) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is 1-[2-[piperidin-3-ylmethyl(propyl)amino]acetyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[piperidin-3-ylmethyl(propyl)amino]acetyl]imidazolidin-2-one
PubChem CID106640737
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC Name1-[2-[piperidin-3-ylmethyl(propyl)amino]acetyl]imidazolidin-2-one
SMILESCCCN(CC(=O)N1CCNC1=O)CC1CCCNC1
InChIInChI=1S/C14H26N4O2/c1-2-7-17(10-12-4-3-5-15-9-12)11-13(19)18-8-6-16-14(18)20/h12,15H,2-11H2,1H3,(H,16,20)
InChIKeyMTDAMHUPRNMSMK-UHFFFAOYSA-N
XLogP0.25
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[piperidin-3-ylmethyl(propyl)amino]-1-pyrrolidin-1-ylethanone
CID 106640711
1-[2-[piperidin-3-ylmethyl(propyl)amino]ethyl]imidazolidin-2-one
CID 106640651
N'-acetyl-2-[piperidin-3-ylmethyl(propyl)amino]acetohydrazide
CID 106640655
N-butan-2-yl-2-[piperidin-3-ylmethyl(propyl)amino]acetamide
CID 106640806
N-methyl-2-[piperidin-3-ylmethyl(propyl)amino]-N-propan-2-ylacetamide
CID 106640901
N-(furan-2-ylmethyl)-2-[piperidin-3-ylmethyl(propyl)amino]acetamide
CID 106640892
3-[piperidin-3-ylmethyl(propyl)amino]propan-1-ol
CID 106640793
1-methyl-5-[[piperidin-3-ylmethyl(propyl)amino]methyl]pyrazole-4-carboxylic acid
CID 106640733
1-[2-[propyl(pyrrolidin-2-ylmethyl)amino]acetyl]pyrrolidin-2-one
CID 106615823
4-[[piperidin-3-ylmethyl(propyl)amino]methyl]benzamide
CID 106640797
N-(2-methylsulfanylethyl)-N-(piperidin-3-ylmethyl)propan-1-amine
CID 106640432
3-[2-[cyclopropyl(piperidin-3-ylmethyl)amino]acetyl]-1,3-oxazolidin-2-one
CID 106640057

Frequently Asked Questions

What is the IUPAC name of 1-[2-[piperidin-3-ylmethyl(propyl)amino]acetyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[piperidin-3-ylmethyl(propyl)amino]acetyl]imidazolidin-2-one (CID 106640737) is 1-[2-[piperidin-3-ylmethyl(propyl)amino]acetyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[piperidin-3-ylmethyl(propyl)amino]acetyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[piperidin-3-ylmethyl(propyl)amino]acetyl]imidazolidin-2-one is CCCN(CC(=O)N1CCNC1=O)CC1CCCNC1.
What is the InChIKey of 1-[2-[piperidin-3-ylmethyl(propyl)amino]acetyl]imidazolidin-2-one?
The InChIKey is MTDAMHUPRNMSMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O2/c1-2-7-17(10-12-4-3-5-15-9-12)11-13(19)18-8-6-16-14(18)20/h12,15H,2-11H2,1H3,(H,16,20).
What are the key properties of 1-[2-[piperidin-3-ylmethyl(propyl)amino]acetyl]imidazolidin-2-one?
1-[2-[piperidin-3-ylmethyl(propyl)amino]acetyl]imidazolidin-2-one has a molecular weight of 282.39 g/mol, XLogP of 0.25, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[piperidin-3-ylmethyl(propyl)amino]acetyl]imidazolidin-2-one is sourced from PubChem (CID 106640737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).