[6-(diethylamino)-2-methylpyrimidin-4-yl]-piperidin-1-ylmethanone

C15H24N4O — CID 109363663

IUPAC[6-(diethylamino)-2-methylpyrimidin-4-yl]-piperidin-1-ylmethanone
SMILESCCN(CC)c1cc(C(=O)N2CCCCC2)nc(C)n1
InChIInChI=1S/C15H24N4O/c1-4-18(5-2)14-11-13(16-12(3)17-14)15(20)19-9-7-6-8-10-19/h11H,4-10H2,1-3H3
InChIKeyKWZNNKDBTGVKDV-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.26
Rot. Bonds4

About [6-(diethylamino)-2-methylpyrimidin-4-yl]-piperidin-1-ylmethanone

[6-(diethylamino)-2-methylpyrimidin-4-yl]-piperidin-1-ylmethanone (PubChem CID 109363663) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is [6-(diethylamino)-2-methylpyrimidin-4-yl]-piperidin-1-ylmethanone.

Molecular Properties

Compound Name[6-(diethylamino)-2-methylpyrimidin-4-yl]-piperidin-1-ylmethanone
PubChem CID109363663
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name[6-(diethylamino)-2-methylpyrimidin-4-yl]-piperidin-1-ylmethanone
SMILESCCN(CC)c1cc(C(=O)N2CCCCC2)nc(C)n1
InChIInChI=1S/C15H24N4O/c1-4-18(5-2)14-11-13(16-12(3)17-14)15(20)19-9-7-6-8-10-19/h11H,4-10H2,1-3H3
InChIKeyKWZNNKDBTGVKDV-UHFFFAOYSA-N
XLogP2.26
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[6-(diethylamino)-2-methylpyrimidin-4-yl]-(2-ethylpiperidin-1-yl)methanone
CID 109373283
azepan-1-yl-[6-[(1,1-dioxothiolan-3-yl)-ethylamino]-2-methylpyrimidin-4-yl]methanone
CID 109372969
azepan-1-yl-[6-(diethylamino)pyridazin-3-yl]methanone
CID 109124285
[6-(azepan-1-yl)-2-methylpyrimidin-4-yl]-piperidin-1-ylmethanone
CID 109363677
[6-[[(2R)-butan-2-yl]amino]-2-methylpyrimidin-4-yl]-piperidin-1-ylmethanone
CID 97458122
N-cyclohexyl-6-(diethylamino)-2-methylpyrimidine-4-carboxamide
CID 109363988
[6-[benzyl(propan-2-yl)amino]-2-methylpyrimidin-4-yl]-pyrrolidin-1-ylmethanone
CID 109362945
[2-methyl-6-(propan-2-ylamino)pyrimidin-4-yl]-piperidin-1-ylmethanone
CID 109360380
[6-(N-ethylanilino)-2-methylpyrimidin-4-yl]-(4-methylpiperazin-1-yl)methanone
CID 109367085
ethyl 4-[2-methyl-6-(piperidine-1-carbonyl)pyrimidin-4-yl]piperazine-1-carboxylate
CID 109363656
[6-(difluoromethyl)-2-methylpyrimidin-4-yl]-pyrrolidin-1-ylmethanone
CID 165431443
1-[4-[6-(azepane-1-carbonyl)-2-methylpyrimidin-4-yl]piperazin-1-yl]ethanone
CID 109367746

Frequently Asked Questions

What is the IUPAC name of [6-(diethylamino)-2-methylpyrimidin-4-yl]-piperidin-1-ylmethanone?
The IUPAC name of [6-(diethylamino)-2-methylpyrimidin-4-yl]-piperidin-1-ylmethanone (CID 109363663) is [6-(diethylamino)-2-methylpyrimidin-4-yl]-piperidin-1-ylmethanone.
What is the SMILES notation for [6-(diethylamino)-2-methylpyrimidin-4-yl]-piperidin-1-ylmethanone?
The canonical SMILES for [6-(diethylamino)-2-methylpyrimidin-4-yl]-piperidin-1-ylmethanone is CCN(CC)c1cc(C(=O)N2CCCCC2)nc(C)n1.
What is the InChIKey of [6-(diethylamino)-2-methylpyrimidin-4-yl]-piperidin-1-ylmethanone?
The InChIKey is KWZNNKDBTGVKDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-4-18(5-2)14-11-13(16-12(3)17-14)15(20)19-9-7-6-8-10-19/h11H,4-10H2,1-3H3.
What are the key properties of [6-(diethylamino)-2-methylpyrimidin-4-yl]-piperidin-1-ylmethanone?
[6-(diethylamino)-2-methylpyrimidin-4-yl]-piperidin-1-ylmethanone has a molecular weight of 276.38 g/mol, XLogP of 2.26, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(diethylamino)-2-methylpyrimidin-4-yl]-piperidin-1-ylmethanone is sourced from PubChem (CID 109363663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).