N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperidin-4-ylacetamide

C14H22N4O — CID 92632152

IUPACN-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperidin-4-ylacetamide
SMILESCc1cc(C)nc(CNC(=O)CC2CCNCC2)n1
InChIInChI=1S/C14H22N4O/c1-10-7-11(2)18-13(17-10)9-16-14(19)8-12-3-5-15-6-4-12/h7,12,15H,3-6,8-9H2,1-2H3,(H,16,19)
InChIKeySQHCJZLNXSRTPE-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.10
Rot. Bonds4

About N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperidin-4-ylacetamide

N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperidin-4-ylacetamide (PubChem CID 92632152) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperidin-4-ylacetamide.

Molecular Properties

Compound NameN-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperidin-4-ylacetamide
PubChem CID92632152
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC NameN-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperidin-4-ylacetamide
SMILESCc1cc(C)nc(CNC(=O)CC2CCNCC2)n1
InChIInChI=1S/C14H22N4O/c1-10-7-11(2)18-13(17-10)9-16-14(19)8-12-3-5-15-6-4-12/h7,12,15H,3-6,8-9H2,1-2H3,(H,16,19)
InChIKeySQHCJZLNXSRTPE-UHFFFAOYSA-N
XLogP1.10
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-piperidin-4-ylacetamide
CID 61284018
N-[(3,4-dimethylphenyl)methyl]-2-piperidin-4-ylacetamide
CID 115160672
N-[(2-methylpyrimidin-4-yl)methyl]-2-piperidin-4-ylacetamide
CID 54910978
2-cyclopentyl-N-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)methyl]acetamide
CID 122319033
2-(1-ethylpiperidin-4-yl)-N-[[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]methyl]acetamide
CID 72939700
N-[(3-methoxyphenyl)methyl]-2-piperidin-4-ylacetamide
CID 61028976
N-[(2,4-dimethoxyphenyl)methyl]-2-piperidin-4-ylacetamide
CID 63362840
4-[(4,6-dimethylpyrimidin-2-yl)methyl]azepane
CID 84685067
N-[[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]methyl]azepane-4-carboxamide
CID 122562699
N-[(2,4-difluorophenyl)methyl]-2-piperidin-4-ylacetamide;hydrochloride
CID 119708033
3-amino-N-[(4,6-dimethylpyrimidin-2-yl)methyl]cyclopentane-1-carboxamide
CID 156609240
2-piperidin-4-yl-N-prop-2-ynylacetamide
CID 61028682

Frequently Asked Questions

What is the IUPAC name of N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperidin-4-ylacetamide?
The IUPAC name of N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperidin-4-ylacetamide (CID 92632152) is N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperidin-4-ylacetamide.
What is the SMILES notation for N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperidin-4-ylacetamide?
The canonical SMILES for N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperidin-4-ylacetamide is Cc1cc(C)nc(CNC(=O)CC2CCNCC2)n1.
What is the InChIKey of N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperidin-4-ylacetamide?
The InChIKey is SQHCJZLNXSRTPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-10-7-11(2)18-13(17-10)9-16-14(19)8-12-3-5-15-6-4-12/h7,12,15H,3-6,8-9H2,1-2H3,(H,16,19).
What are the key properties of N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperidin-4-ylacetamide?
N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperidin-4-ylacetamide has a molecular weight of 262.36 g/mol, XLogP of 1.10, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperidin-4-ylacetamide is sourced from PubChem (CID 92632152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).