2-[4-[(5-amino-6-oxo-1H-pyrimidin-4-yl)amino]piperidin-1-yl]acetamide

C11H18N6O2 — CID 136974324

IUPAC2-[4-[(5-amino-6-oxo-1H-pyrimidin-4-yl)amino]piperidin-1-yl]acetamide
SMILESNC(=O)CN1CCC(Nc2nc[nH]c(=O)c2N)CC1
InChIInChI=1S/C11H18N6O2/c12-8(18)5-17-3-1-7(2-4-17)16-10-9(13)11(19)15-6-14-10/h6-7H,1-5,13H2,(H2,12,18)(H2,14,15,16,19)
InChIKeyUXLNSUQOHAUVOU-UHFFFAOYSA-N
MW266.30 g/mol
LogP-1.29
Rot. Bonds4

About 2-[4-[(5-amino-6-oxo-1H-pyrimidin-4-yl)amino]piperidin-1-yl]acetamide

2-[4-[(5-amino-6-oxo-1H-pyrimidin-4-yl)amino]piperidin-1-yl]acetamide (PubChem CID 136974324) has the molecular formula C11H18N6O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is 2-[4-[(5-amino-6-oxo-1H-pyrimidin-4-yl)amino]piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-[(5-amino-6-oxo-1H-pyrimidin-4-yl)amino]piperidin-1-yl]acetamide
PubChem CID136974324
Molecular FormulaC11H18N6O2
Molecular Weight266.30 g/mol
Exact Mass266.15
IUPAC Name2-[4-[(5-amino-6-oxo-1H-pyrimidin-4-yl)amino]piperidin-1-yl]acetamide
SMILESNC(=O)CN1CCC(Nc2nc[nH]c(=O)c2N)CC1
InChIInChI=1S/C11H18N6O2/c12-8(18)5-17-3-1-7(2-4-17)16-10-9(13)11(19)15-6-14-10/h6-7H,1-5,13H2,(H2,12,18)(H2,14,15,16,19)
InChIKeyUXLNSUQOHAUVOU-UHFFFAOYSA-N
XLogP-1.29
TPSA130.13 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 5-1.29
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[(5-amino-6-oxo-1H-pyrimidin-4-yl)amino]piperidin-1-yl]acetamide?
The IUPAC name of 2-[4-[(5-amino-6-oxo-1H-pyrimidin-4-yl)amino]piperidin-1-yl]acetamide (CID 136974324) is 2-[4-[(5-amino-6-oxo-1H-pyrimidin-4-yl)amino]piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[4-[(5-amino-6-oxo-1H-pyrimidin-4-yl)amino]piperidin-1-yl]acetamide?
The canonical SMILES for 2-[4-[(5-amino-6-oxo-1H-pyrimidin-4-yl)amino]piperidin-1-yl]acetamide is NC(=O)CN1CCC(Nc2nc[nH]c(=O)c2N)CC1.
What is the InChIKey of 2-[4-[(5-amino-6-oxo-1H-pyrimidin-4-yl)amino]piperidin-1-yl]acetamide?
The InChIKey is UXLNSUQOHAUVOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N6O2/c12-8(18)5-17-3-1-7(2-4-17)16-10-9(13)11(19)15-6-14-10/h6-7H,1-5,13H2,(H2,12,18)(H2,14,15,16,19).
What are the key properties of 2-[4-[(5-amino-6-oxo-1H-pyrimidin-4-yl)amino]piperidin-1-yl]acetamide?
2-[4-[(5-amino-6-oxo-1H-pyrimidin-4-yl)amino]piperidin-1-yl]acetamide has a molecular weight of 266.30 g/mol, XLogP of -1.29, 4 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(5-amino-6-oxo-1H-pyrimidin-4-yl)amino]piperidin-1-yl]acetamide is sourced from PubChem (CID 136974324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).