N-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]acetamide

C14H20N4O — CID 133300182

IUPACN-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]acetamide
SMILESCC(=O)NC1CCN(c2ccnc(C3CC3)n2)CC1
InChIInChI=1S/C14H20N4O/c1-10(19)16-12-5-8-18(9-6-12)13-4-7-15-14(17-13)11-2-3-11/h4,7,11-12H,2-3,5-6,8-9H2,1H3,(H,16,19)
InChIKeyCYBSYLPUFQAKDM-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.46
Rot. Bonds3

About N-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]acetamide

N-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]acetamide (PubChem CID 133300182) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is N-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]acetamide.

Molecular Properties

Compound NameN-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]acetamide
PubChem CID133300182
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC NameN-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]acetamide
SMILESCC(=O)NC1CCN(c2ccnc(C3CC3)n2)CC1
InChIInChI=1S/C14H20N4O/c1-10(19)16-12-5-8-18(9-6-12)13-4-7-15-14(17-13)11-2-3-11/h4,7,11-12H,2-3,5-6,8-9H2,1H3,(H,16,19)
InChIKeyCYBSYLPUFQAKDM-UHFFFAOYSA-N
XLogP1.46
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]acetamide?
The IUPAC name of N-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]acetamide (CID 133300182) is N-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]acetamide.
What is the SMILES notation for N-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]acetamide?
The canonical SMILES for N-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]acetamide is CC(=O)NC1CCN(c2ccnc(C3CC3)n2)CC1.
What is the InChIKey of N-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]acetamide?
The InChIKey is CYBSYLPUFQAKDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-10(19)16-12-5-8-18(9-6-12)13-4-7-15-14(17-13)11-2-3-11/h4,7,11-12H,2-3,5-6,8-9H2,1H3,(H,16,19).
What are the key properties of N-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]acetamide?
N-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]acetamide has a molecular weight of 260.34 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-cyclopropylpyrimidin-4-yl)piperidin-4-yl]acetamide is sourced from PubChem (CID 133300182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).