N-cyclohexyl-1-(3-ethyl-1-methyl-2,6-dioxopyrimidin-4-yl)piperidine-3-carboxamide

C19H30N4O3 — CID 53010365

IUPACN-cyclohexyl-1-(3-ethyl-1-methyl-2,6-dioxopyrimidin-4-yl)piperidine-3-carboxamide
SMILESCCn1c(N2CCCC(C(=O)NC3CCCCC3)C2)cc(=O)n(C)c1=O
InChIInChI=1S/C19H30N4O3/c1-3-23-16(12-17(24)21(2)19(23)26)22-11-7-8-14(13-22)18(25)20-15-9-5-4-6-10-15/h12,14-15H,3-11,13H2,1-2H3,(H,20,25)
InChIKeyRULBKAXGMYVSFZ-UHFFFAOYSA-N
MW362.47 g/mol
LogP1.23
Rot. Bonds4

About N-cyclohexyl-1-(3-ethyl-1-methyl-2,6-dioxopyrimidin-4-yl)piperidine-3-carboxamide

N-cyclohexyl-1-(3-ethyl-1-methyl-2,6-dioxopyrimidin-4-yl)piperidine-3-carboxamide (PubChem CID 53010365) has the molecular formula C19H30N4O3 and a molecular weight of 362.47 g/mol. Its IUPAC name is N-cyclohexyl-1-(3-ethyl-1-methyl-2,6-dioxopyrimidin-4-yl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-1-(3-ethyl-1-methyl-2,6-dioxopyrimidin-4-yl)piperidine-3-carboxamide
PubChem CID53010365
Molecular FormulaC19H30N4O3
Molecular Weight362.47 g/mol
Exact Mass362.23
IUPAC NameN-cyclohexyl-1-(3-ethyl-1-methyl-2,6-dioxopyrimidin-4-yl)piperidine-3-carboxamide
SMILESCCn1c(N2CCCC(C(=O)NC3CCCCC3)C2)cc(=O)n(C)c1=O
InChIInChI=1S/C19H30N4O3/c1-3-23-16(12-17(24)21(2)19(23)26)22-11-7-8-14(13-22)18(25)20-15-9-5-4-6-10-15/h12,14-15H,3-11,13H2,1-2H3,(H,20,25)
InChIKeyRULBKAXGMYVSFZ-UHFFFAOYSA-N
XLogP1.23
TPSA76.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-(3-ethyl-1-methyl-2,6-dioxopyrimidin-4-yl)piperidine-3-carboxamide?
The IUPAC name of N-cyclohexyl-1-(3-ethyl-1-methyl-2,6-dioxopyrimidin-4-yl)piperidine-3-carboxamide (CID 53010365) is N-cyclohexyl-1-(3-ethyl-1-methyl-2,6-dioxopyrimidin-4-yl)piperidine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-1-(3-ethyl-1-methyl-2,6-dioxopyrimidin-4-yl)piperidine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-1-(3-ethyl-1-methyl-2,6-dioxopyrimidin-4-yl)piperidine-3-carboxamide is CCn1c(N2CCCC(C(=O)NC3CCCCC3)C2)cc(=O)n(C)c1=O.
What is the InChIKey of N-cyclohexyl-1-(3-ethyl-1-methyl-2,6-dioxopyrimidin-4-yl)piperidine-3-carboxamide?
The InChIKey is RULBKAXGMYVSFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4O3/c1-3-23-16(12-17(24)21(2)19(23)26)22-11-7-8-14(13-22)18(25)20-15-9-5-4-6-10-15/h12,14-15H,3-11,13H2,1-2H3,(H,20,25).
What are the key properties of N-cyclohexyl-1-(3-ethyl-1-methyl-2,6-dioxopyrimidin-4-yl)piperidine-3-carboxamide?
N-cyclohexyl-1-(3-ethyl-1-methyl-2,6-dioxopyrimidin-4-yl)piperidine-3-carboxamide has a molecular weight of 362.47 g/mol, XLogP of 1.23, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-(3-ethyl-1-methyl-2,6-dioxopyrimidin-4-yl)piperidine-3-carboxamide is sourced from PubChem (CID 53010365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).