1-(4-methoxy-6-methylpyrimidin-2-yl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide

C17H26N4O3 — CID 24981339

IUPAC1-(4-methoxy-6-methylpyrimidin-2-yl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide
SMILESCOc1cc(C)nc(N2CCC(C(=O)NCC3CCCO3)CC2)n1
InChIInChI=1S/C17H26N4O3/c1-12-10-15(23-2)20-17(19-12)21-7-5-13(6-8-21)16(22)18-11-14-4-3-9-24-14/h10,13-14H,3-9,11H2,1-2H3,(H,18,22)
InChIKeyLZTGZHMVJZSGFI-UHFFFAOYSA-N
MW334.42 g/mol
LogP1.31
Rot. Bonds5

About 1-(4-methoxy-6-methylpyrimidin-2-yl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide

1-(4-methoxy-6-methylpyrimidin-2-yl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide (PubChem CID 24981339) has the molecular formula C17H26N4O3 and a molecular weight of 334.42 g/mol. Its IUPAC name is 1-(4-methoxy-6-methylpyrimidin-2-yl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4-methoxy-6-methylpyrimidin-2-yl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide
PubChem CID24981339
Molecular FormulaC17H26N4O3
Molecular Weight334.42 g/mol
Exact Mass334.20
IUPAC Name1-(4-methoxy-6-methylpyrimidin-2-yl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide
SMILESCOc1cc(C)nc(N2CCC(C(=O)NCC3CCCO3)CC2)n1
InChIInChI=1S/C17H26N4O3/c1-12-10-15(23-2)20-17(19-12)21-7-5-13(6-8-21)16(22)18-11-14-4-3-9-24-14/h10,13-14H,3-9,11H2,1-2H3,(H,18,22)
InChIKeyLZTGZHMVJZSGFI-UHFFFAOYSA-N
XLogP1.31
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-(4-methoxy-6-methylpyrimidin-2-yl)-N-(2-methylpropyl)piperidine-3-carboxamide
CID 3228706
1-(4-Methoxy-6-methyl-pyrimidin-2-yl)-piperidine-4-carboxylic acid amide
CID 649678
1-(4-Methoxy-6-methyl-pyrimidin-2-yl)-piperidine-3-carboxylic acid (4-methyl-cyclohexyl)-amide
CID 649779
1-(4-Methoxy-6-methyl-pyrimidin-2-yl)-piperidine-3-carboxylic acid sec-butylamide
CID 3228704
1-(4-Methoxy-6-methyl-pyrimidin-2-yl)-piperidine-4-carboxylic acid cyclohexylamide
CID 645094
1-(4-Ethoxy-6-methyl-pyrimidin-2-yl)-piperidine-4-carboxylic acid (tetrahydro-furan-2-ylmethyl)-amide
CID 42628126
1-(4-Ethoxy-6-methyl-pyrimidin-2-yl)-piperidine-4-carboxylic acid cyclopropylamide
CID 42628171
2-Cyclopentyloxy-1-[4-(4-methoxy-6-methylpyrimidin-2-yl)piperazin-1-yl]ethanone
CID 53592049
[(3S,4R)-3-[(4-methoxy-6-methylpyrimidin-2-yl)amino]-4-(trifluoromethyl)pyrrolidin-1-yl]-(oxan-3-yl)methanone
CID 154810698
1-(4-methoxy-6-methylpyrimidin-2-yl)-N-(oxolan-2-ylmethyl)piperidine-3-carboxamide
CID 3228705
1-(4-methoxy-6-methylpyrimidin-2-yl)-N-(2-methylbutan-2-yl)piperidine-3-carboxamide
CID 3228709
N-cyclohexyl-1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidine-4-carboxamide
CID 3228714

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-6-methylpyrimidin-2-yl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide?
The IUPAC name of 1-(4-methoxy-6-methylpyrimidin-2-yl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide (CID 24981339) is 1-(4-methoxy-6-methylpyrimidin-2-yl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(4-methoxy-6-methylpyrimidin-2-yl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(4-methoxy-6-methylpyrimidin-2-yl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide is COc1cc(C)nc(N2CCC(C(=O)NCC3CCCO3)CC2)n1.
What is the InChIKey of 1-(4-methoxy-6-methylpyrimidin-2-yl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide?
The InChIKey is LZTGZHMVJZSGFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O3/c1-12-10-15(23-2)20-17(19-12)21-7-5-13(6-8-21)16(22)18-11-14-4-3-9-24-14/h10,13-14H,3-9,11H2,1-2H3,(H,18,22).
What are the key properties of 1-(4-methoxy-6-methylpyrimidin-2-yl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide?
1-(4-methoxy-6-methylpyrimidin-2-yl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide has a molecular weight of 334.42 g/mol, XLogP of 1.31, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-6-methylpyrimidin-2-yl)-N-(oxolan-2-ylmethyl)piperidine-4-carboxamide is sourced from PubChem (CID 24981339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).