1-[2-(3-aminopiperidin-1-yl)acetyl]imidazolidin-2-one

C10H18N4O2 — CID 61297595

IUPAC1-[2-(3-aminopiperidin-1-yl)acetyl]imidazolidin-2-one
SMILESNC1CCCN(CC(=O)N2CCNC2=O)C1
InChIInChI=1S/C10H18N4O2/c11-8-2-1-4-13(6-8)7-9(15)14-5-3-12-10(14)16/h8H,1-7,11H2,(H,12,16)
InChIKeyPADNZPZZRCOMLL-UHFFFAOYSA-N
MW226.28 g/mol
LogP-1.04
Rot. Bonds2

About 1-[2-(3-aminopiperidin-1-yl)acetyl]imidazolidin-2-one

1-[2-(3-aminopiperidin-1-yl)acetyl]imidazolidin-2-one (PubChem CID 61297595) has the molecular formula C10H18N4O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is 1-[2-(3-aminopiperidin-1-yl)acetyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-(3-aminopiperidin-1-yl)acetyl]imidazolidin-2-one
PubChem CID61297595
Molecular FormulaC10H18N4O2
Molecular Weight226.28 g/mol
Exact Mass226.14
IUPAC Name1-[2-(3-aminopiperidin-1-yl)acetyl]imidazolidin-2-one
SMILESNC1CCCN(CC(=O)N2CCNC2=O)C1
InChIInChI=1S/C10H18N4O2/c11-8-2-1-4-13(6-8)7-9(15)14-5-3-12-10(14)16/h8H,1-7,11H2,(H,12,16)
InChIKeyPADNZPZZRCOMLL-UHFFFAOYSA-N
XLogP-1.04
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 5-1.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-aminopiperidin-1-yl)acetyl]imidazolidin-2-one?
The IUPAC name of 1-[2-(3-aminopiperidin-1-yl)acetyl]imidazolidin-2-one (CID 61297595) is 1-[2-(3-aminopiperidin-1-yl)acetyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-(3-aminopiperidin-1-yl)acetyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-(3-aminopiperidin-1-yl)acetyl]imidazolidin-2-one is NC1CCCN(CC(=O)N2CCNC2=O)C1.
What is the InChIKey of 1-[2-(3-aminopiperidin-1-yl)acetyl]imidazolidin-2-one?
The InChIKey is PADNZPZZRCOMLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2/c11-8-2-1-4-13(6-8)7-9(15)14-5-3-12-10(14)16/h8H,1-7,11H2,(H,12,16).
What are the key properties of 1-[2-(3-aminopiperidin-1-yl)acetyl]imidazolidin-2-one?
1-[2-(3-aminopiperidin-1-yl)acetyl]imidazolidin-2-one has a molecular weight of 226.28 g/mol, XLogP of -1.04, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-aminopiperidin-1-yl)acetyl]imidazolidin-2-one is sourced from PubChem (CID 61297595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).