N-[1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperidin-4-yl]-N-methylcyclopropanecarboxamide

C16H24N4O3 — CID 171326539

IUPACN-[1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperidin-4-yl]-N-methylcyclopropanecarboxamide
SMILESCN(C(=O)C1CC1)C1CCN(c2cc(=O)n(C)c(=O)n2C)CC1
InChIInChI=1S/C16H24N4O3/c1-17(15(22)11-4-5-11)12-6-8-20(9-7-12)13-10-14(21)19(3)16(23)18(13)2/h10-12H,4-9H2,1-3H3
InChIKeyMKXYEIVUZUZWNA-UHFFFAOYSA-N
MW320.39 g/mol
LogP-0.08
Rot. Bonds3

About N-[1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperidin-4-yl]-N-methylcyclopropanecarboxamide

N-[1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperidin-4-yl]-N-methylcyclopropanecarboxamide (PubChem CID 171326539) has the molecular formula C16H24N4O3 and a molecular weight of 320.39 g/mol. Its IUPAC name is N-[1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperidin-4-yl]-N-methylcyclopropanecarboxamide.

Molecular Properties

Compound NameN-[1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperidin-4-yl]-N-methylcyclopropanecarboxamide
PubChem CID171326539
Molecular FormulaC16H24N4O3
Molecular Weight320.39 g/mol
Exact Mass320.18
IUPAC NameN-[1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperidin-4-yl]-N-methylcyclopropanecarboxamide
SMILESCN(C(=O)C1CC1)C1CCN(c2cc(=O)n(C)c(=O)n2C)CC1
InChIInChI=1S/C16H24N4O3/c1-17(15(22)11-4-5-11)12-6-8-20(9-7-12)13-10-14(21)19(3)16(23)18(13)2/h10-12H,4-9H2,1-3H3
InChIKeyMKXYEIVUZUZWNA-UHFFFAOYSA-N
XLogP-0.08
TPSA67.55 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 5-0.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

6-[4-(4-benzylpiperidine-1-carbonyl)piperidin-1-yl]-1,3-dimethylpyrimidine-2,4-dione
CID 46381270
1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N-(furan-2-ylmethyl)piperidine-4-carboxamide
CID 46381273
6-[4-(2-methoxyacetyl)piperazin-1-yl]-1,3-dimethylpyrimidine-2,4-dione
CID 53010421
N-(3-chloro-4-fluorophenyl)-1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperidine-4-carboxamide
CID 46381251
N-[1-(5-chloropyrimidin-4-yl)piperidin-4-yl]-N-methylcyclopropanecarboxamide
CID 172890939
1,3-dimethyl-6-[(3R)-3-(morpholine-4-carbonyl)piperidin-1-yl]pyrimidine-2,4-dione
CID 93070846
1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N-phenylpiperidine-3-carboxamide
CID 53107443
1,3-dimethyl-6-[4-(2-methyl-6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]pyrimidine-2,4-dione
CID 155942358
N-methyl-N-[1-(6-methyl-1,3-benzothiazol-2-yl)piperidin-4-yl]cyclopropanecarboxamide
CID 171328840
N-cycloheptyl-1-(3-ethyl-1-methyl-2,6-dioxopyrimidin-4-yl)piperidine-4-carboxamide
CID 46381364
4-[cycloheptyl(methyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 63784841
N-(4-hydroxycyclohexyl)-N,1-dimethylpiperidine-4-carboxamide
CID 115277411

Frequently Asked Questions

What is the IUPAC name of N-[1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperidin-4-yl]-N-methylcyclopropanecarboxamide?
The IUPAC name of N-[1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperidin-4-yl]-N-methylcyclopropanecarboxamide (CID 171326539) is N-[1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperidin-4-yl]-N-methylcyclopropanecarboxamide.
What is the SMILES notation for N-[1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperidin-4-yl]-N-methylcyclopropanecarboxamide?
The canonical SMILES for N-[1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperidin-4-yl]-N-methylcyclopropanecarboxamide is CN(C(=O)C1CC1)C1CCN(c2cc(=O)n(C)c(=O)n2C)CC1.
What is the InChIKey of N-[1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperidin-4-yl]-N-methylcyclopropanecarboxamide?
The InChIKey is MKXYEIVUZUZWNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O3/c1-17(15(22)11-4-5-11)12-6-8-20(9-7-12)13-10-14(21)19(3)16(23)18(13)2/h10-12H,4-9H2,1-3H3.
What are the key properties of N-[1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperidin-4-yl]-N-methylcyclopropanecarboxamide?
N-[1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperidin-4-yl]-N-methylcyclopropanecarboxamide has a molecular weight of 320.39 g/mol, XLogP of -0.08, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperidin-4-yl]-N-methylcyclopropanecarboxamide is sourced from PubChem (CID 171326539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).