1-(oxane-4-carbonyl)piperidine-4-carboxamide

C12H20N2O3 — CID 23626903

IUPAC1-(oxane-4-carbonyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)C2CCOCC2)CC1
InChIInChI=1S/C12H20N2O3/c13-11(15)9-1-5-14(6-2-9)12(16)10-3-7-17-8-4-10/h9-10H,1-8H2,(H2,13,15)
InChIKeyIJMXPPGPGNZSEN-UHFFFAOYSA-N
MW240.30 g/mol
LogP0.14
Rot. Bonds2

About 1-(oxane-4-carbonyl)piperidine-4-carboxamide

1-(oxane-4-carbonyl)piperidine-4-carboxamide (PubChem CID 23626903) has the molecular formula C12H20N2O3 and a molecular weight of 240.30 g/mol. Its IUPAC name is 1-(oxane-4-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(oxane-4-carbonyl)piperidine-4-carboxamide
PubChem CID23626903
Molecular FormulaC12H20N2O3
Molecular Weight240.30 g/mol
Exact Mass240.15
IUPAC Name1-(oxane-4-carbonyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)C2CCOCC2)CC1
InChIInChI=1S/C12H20N2O3/c13-11(15)9-1-5-14(6-2-9)12(16)10-3-7-17-8-4-10/h9-10H,1-8H2,(H2,13,15)
InChIKeyIJMXPPGPGNZSEN-UHFFFAOYSA-N
XLogP0.14
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(piperidin-4-yl)oxane-4-carboxamide
CID 43345755
1-(Oxane-4-carbonyl)piperidine
CID 24229804
2,8-Diazaspiro[4.5]decan-2-yl(oxan-4-yl)methanone
CID 97528497
5-[1-(Oxane-4-carbonyl)piperidine-4-carbonyl]-1,5-diazacycloundecan-2-one
CID 110201691
1-Acetyl-N-methyl-N-[(4-methyloxan-4-YL)methyl]piperidine-4-carboxamide
CID 110875716
(4-(2-fluoroethyl)piperazin-1-yl)(tetrahydro-2H-pyran-4-yl)methanone
CID 121021921
N-{[1-(2,2,2-Trifluoroethyl)piperidin-4-YL]methyl}oxane-4-carboxamide
CID 99827639
N-(oxan-4-ylmethyl)-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide
CID 110736401
N-methyl-N-(oxan-4-ylmethyl)-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide
CID 110752443
(4,4-difluoropiperidin-1-yl)(tetrahydro-2H-pyran-4-yl)methanone
CID 121184589
Ethyl 1-(4-aminobutanoyl)piperidine-4-carboxylate
CID 22692245
[1-(Oxane-4-carbonyl)piperidin-4-yl]methanamine
CID 23626904

Frequently Asked Questions

What is the IUPAC name of 1-(oxane-4-carbonyl)piperidine-4-carboxamide?
The IUPAC name of 1-(oxane-4-carbonyl)piperidine-4-carboxamide (CID 23626903) is 1-(oxane-4-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(oxane-4-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(oxane-4-carbonyl)piperidine-4-carboxamide is NC(=O)C1CCN(C(=O)C2CCOCC2)CC1.
What is the InChIKey of 1-(oxane-4-carbonyl)piperidine-4-carboxamide?
The InChIKey is IJMXPPGPGNZSEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O3/c13-11(15)9-1-5-14(6-2-9)12(16)10-3-7-17-8-4-10/h9-10H,1-8H2,(H2,13,15).
What are the key properties of 1-(oxane-4-carbonyl)piperidine-4-carboxamide?
1-(oxane-4-carbonyl)piperidine-4-carboxamide has a molecular weight of 240.30 g/mol, XLogP of 0.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxane-4-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 23626903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).