N-methyl-2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-6-carboxamide

C11H16N4O3 — CID 43602147

IUPACN-methyl-2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-6-carboxamide
SMILESCN(C(=O)c1cc(=O)[nH]c(=O)[nH]1)C1CCNCC1
InChIInChI=1S/C11H16N4O3/c1-15(7-2-4-12-5-3-7)10(17)8-6-9(16)14-11(18)13-8/h6-7,12H,2-5H2,1H3,(H2,13,14,16,18)
InChIKeyLYNGRMKVURWDPU-UHFFFAOYSA-N
MW252.27 g/mol
LogP-1.11
Rot. Bonds2

About N-methyl-2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-6-carboxamide

N-methyl-2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-6-carboxamide (PubChem CID 43602147) has the molecular formula C11H16N4O3 and a molecular weight of 252.27 g/mol. Its IUPAC name is N-methyl-2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-6-carboxamide.

Molecular Properties

Compound NameN-methyl-2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-6-carboxamide
PubChem CID43602147
Molecular FormulaC11H16N4O3
Molecular Weight252.27 g/mol
Exact Mass252.12
IUPAC NameN-methyl-2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-6-carboxamide
SMILESCN(C(=O)c1cc(=O)[nH]c(=O)[nH]1)C1CCNCC1
InChIInChI=1S/C11H16N4O3/c1-15(7-2-4-12-5-3-7)10(17)8-6-9(16)14-11(18)13-8/h6-7,12H,2-5H2,1H3,(H2,13,14,16,18)
InChIKeyLYNGRMKVURWDPU-UHFFFAOYSA-N
XLogP-1.11
TPSA98.06 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 5-1.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

6-Amino-1-methyl-5-(1-piperidinyl)-2,4(1H,3H)-pyrimidinedione
CID 2497562
N-hexyl-2,4-dioxo-1H-pyrimidine-6-carboxamide
CID 21204487
6-[(3R)-3-aminopiperidin-1-yl]-1-but-2-ynyl-3-methylpyrimidine-2,4-dione
CID 72707535
5-(Cyclohexylmethylamino)-1,3-dihydropyrimidine-2,4-dione
CID 899001
1,3-Dimethyl-6-(2-piperidin-1-ylethylamino)pyrimidine-2,4-dione
CID 657656
N-hexyl-5-(4-methylpiperazin-1-yl)-2,4-dioxopyrimidine-1-carboxamide
CID 71654889
N-Isopropyl-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxamide
CID 2227167
6-[(3R)-3-aminopiperidin-1-yl]-1,3-bis(but-2-ynyl)pyrimidine-2,4-dione
CID 72707536
2,4-dioxo-N-pentyl-1H-pyrimidine-6-carboxamide
CID 110698284
5-(piperidin-1-yl)pyrimidine-2,4(1H,3H)-dione
CID 745053
1,3-Dimethyl-6-[[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione
CID 56796823
1,3-Dimethyl-6-[[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]methyl]pyrimidine-2,4-dione
CID 56821553

Frequently Asked Questions

What is the IUPAC name of N-methyl-2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-6-carboxamide?
The IUPAC name of N-methyl-2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-6-carboxamide (CID 43602147) is N-methyl-2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-6-carboxamide.
What is the SMILES notation for N-methyl-2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-6-carboxamide?
The canonical SMILES for N-methyl-2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-6-carboxamide is CN(C(=O)c1cc(=O)[nH]c(=O)[nH]1)C1CCNCC1.
What is the InChIKey of N-methyl-2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-6-carboxamide?
The InChIKey is LYNGRMKVURWDPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O3/c1-15(7-2-4-12-5-3-7)10(17)8-6-9(16)14-11(18)13-8/h6-7,12H,2-5H2,1H3,(H2,13,14,16,18).
What are the key properties of N-methyl-2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-6-carboxamide?
N-methyl-2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-6-carboxamide has a molecular weight of 252.27 g/mol, XLogP of -1.11, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2,4-dioxo-N-piperidin-4-yl-1H-pyrimidine-6-carboxamide is sourced from PubChem (CID 43602147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).