1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N-propylpiperidine-3-carboxamide

C15H24N4O3 — CID 53010406

IUPAC1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N-propylpiperidine-3-carboxamide
SMILESCCCNC(=O)C1CCCN(c2cc(=O)n(C)c(=O)n2C)C1
InChIInChI=1S/C15H24N4O3/c1-4-7-16-14(21)11-6-5-8-19(10-11)12-9-13(20)18(3)15(22)17(12)2/h9,11H,4-8,10H2,1-3H3,(H,16,21)
InChIKeyKSJGCUZZYFFQQZ-UHFFFAOYSA-N
MW308.38 g/mol
LogP-0.17
Rot. Bonds4

About 1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N-propylpiperidine-3-carboxamide

1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N-propylpiperidine-3-carboxamide (PubChem CID 53010406) has the molecular formula C15H24N4O3 and a molecular weight of 308.38 g/mol. Its IUPAC name is 1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N-propylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N-propylpiperidine-3-carboxamide
PubChem CID53010406
Molecular FormulaC15H24N4O3
Molecular Weight308.38 g/mol
Exact Mass308.18
IUPAC Name1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N-propylpiperidine-3-carboxamide
SMILESCCCNC(=O)C1CCCN(c2cc(=O)n(C)c(=O)n2C)C1
InChIInChI=1S/C15H24N4O3/c1-4-7-16-14(21)11-6-5-8-19(10-11)12-9-13(20)18(3)15(22)17(12)2/h9,11H,4-8,10H2,1-3H3,(H,16,21)
InChIKeyKSJGCUZZYFFQQZ-UHFFFAOYSA-N
XLogP-0.17
TPSA76.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N-propylpiperidine-3-carboxamide?
The IUPAC name of 1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N-propylpiperidine-3-carboxamide (CID 53010406) is 1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N-propylpiperidine-3-carboxamide.
What is the SMILES notation for 1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N-propylpiperidine-3-carboxamide?
The canonical SMILES for 1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N-propylpiperidine-3-carboxamide is CCCNC(=O)C1CCCN(c2cc(=O)n(C)c(=O)n2C)C1.
What is the InChIKey of 1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N-propylpiperidine-3-carboxamide?
The InChIKey is KSJGCUZZYFFQQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O3/c1-4-7-16-14(21)11-6-5-8-19(10-11)12-9-13(20)18(3)15(22)17(12)2/h9,11H,4-8,10H2,1-3H3,(H,16,21).
What are the key properties of 1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N-propylpiperidine-3-carboxamide?
1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N-propylpiperidine-3-carboxamide has a molecular weight of 308.38 g/mol, XLogP of -0.17, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-N-propylpiperidine-3-carboxamide is sourced from PubChem (CID 53010406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).