N-(5-chloro-3-pyridinyl)-4-(2-oxo-1,3-diazinan-1-yl)piperidine-1-carboxamide

C15H20ClN5O2 — CID 154782658

IUPACN-(5-chloro-3-pyridinyl)-4-(2-oxo-1,3-diazinan-1-yl)piperidine-1-carboxamide
SMILESO=C(Nc1cncc(Cl)c1)N1CCC(N2CCCNC2=O)CC1
InChIInChI=1S/C15H20ClN5O2/c16-11-8-12(10-17-9-11)19-15(23)20-6-2-13(3-7-20)21-5-1-4-18-14(21)22/h8-10,13H,1-7H2,(H,18,22)(H,19,23)
InChIKeyADLDEPHUHYAPQE-UHFFFAOYSA-N
MW337.81 g/mol
LogP2.15
Rot. Bonds2

About N-(5-chloro-3-pyridinyl)-4-(2-oxo-1,3-diazinan-1-yl)piperidine-1-carboxamide

N-(5-chloro-3-pyridinyl)-4-(2-oxo-1,3-diazinan-1-yl)piperidine-1-carboxamide (PubChem CID 154782658) has the molecular formula C15H20ClN5O2 and a molecular weight of 337.81 g/mol. Its IUPAC name is N-(5-chloro-3-pyridinyl)-4-(2-oxo-1,3-diazinan-1-yl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-3-pyridinyl)-4-(2-oxo-1,3-diazinan-1-yl)piperidine-1-carboxamide
PubChem CID154782658
Molecular FormulaC15H20ClN5O2
Molecular Weight337.81 g/mol
Exact Mass337.13
IUPAC NameN-(5-chloro-3-pyridinyl)-4-(2-oxo-1,3-diazinan-1-yl)piperidine-1-carboxamide
SMILESO=C(Nc1cncc(Cl)c1)N1CCC(N2CCCNC2=O)CC1
InChIInChI=1S/C15H20ClN5O2/c16-11-8-12(10-17-9-11)19-15(23)20-6-2-13(3-7-20)21-5-1-4-18-14(21)22/h8-10,13H,1-7H2,(H,18,22)(H,19,23)
InChIKeyADLDEPHUHYAPQE-UHFFFAOYSA-N
XLogP2.15
TPSA77.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.81
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chlorophenyl)-4-(2-oxo-1,3-diazinan-1-yl)piperidine-1-carboxamide
CID 134793891
1-(1-benzoylpiperidin-4-yl)-1,3-diazinan-2-one
CID 134793694
N-(3-chlorophenyl)-3-(triazol-2-yl)pyrrolidine-1-carboxamide
CID 121178780
N-(3,5-dichlorophenyl)-4-hydroxypiperidine-1-carboxamide
CID 113223015
1-[1-(1H-indazole-3-carbonyl)piperidin-4-yl]-1,3-diazinan-2-one
CID 71912055
tert-butyl 4-(2-oxo-1,3-diazinan-1-yl)piperidine-1-carboxylate
CID 53432568
4-(azepan-1-yl)-N-(3-chlorophenyl)piperidine-1-carboxamide
CID 110667169
4-methyl-N-pyrimidin-5-ylpiperidine-1-carboxamide
CID 104859349
N-pyrimidin-5-ylpyrrolidine-1-carboxamide
CID 104859346
N-(3-chlorophenyl)-4-pyridin-3-yloxypiperidine-1-carboxamide
CID 90566112
N-(3-chloro-5-fluorophenyl)-4-pyrazol-1-ylpiperidine-1-carboxamide
CID 84588159
N-(4-chlorophenyl)-4-(2,5-dioxoimidazolidin-1-yl)piperidine-1-carboxamide
CID 121160458

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-3-pyridinyl)-4-(2-oxo-1,3-diazinan-1-yl)piperidine-1-carboxamide?
The IUPAC name of N-(5-chloro-3-pyridinyl)-4-(2-oxo-1,3-diazinan-1-yl)piperidine-1-carboxamide (CID 154782658) is N-(5-chloro-3-pyridinyl)-4-(2-oxo-1,3-diazinan-1-yl)piperidine-1-carboxamide.
What is the SMILES notation for N-(5-chloro-3-pyridinyl)-4-(2-oxo-1,3-diazinan-1-yl)piperidine-1-carboxamide?
The canonical SMILES for N-(5-chloro-3-pyridinyl)-4-(2-oxo-1,3-diazinan-1-yl)piperidine-1-carboxamide is O=C(Nc1cncc(Cl)c1)N1CCC(N2CCCNC2=O)CC1.
What is the InChIKey of N-(5-chloro-3-pyridinyl)-4-(2-oxo-1,3-diazinan-1-yl)piperidine-1-carboxamide?
The InChIKey is ADLDEPHUHYAPQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClN5O2/c16-11-8-12(10-17-9-11)19-15(23)20-6-2-13(3-7-20)21-5-1-4-18-14(21)22/h8-10,13H,1-7H2,(H,18,22)(H,19,23).
What are the key properties of N-(5-chloro-3-pyridinyl)-4-(2-oxo-1,3-diazinan-1-yl)piperidine-1-carboxamide?
N-(5-chloro-3-pyridinyl)-4-(2-oxo-1,3-diazinan-1-yl)piperidine-1-carboxamide has a molecular weight of 337.81 g/mol, XLogP of 2.15, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-3-pyridinyl)-4-(2-oxo-1,3-diazinan-1-yl)piperidine-1-carboxamide is sourced from PubChem (CID 154782658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).