N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-3-propylpiperidine-3-carboxamide

C12H21N3O3 — CID 79523481

IUPACN-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-3-propylpiperidine-3-carboxamide
SMILESCCCC1(C(=O)N[C@@H]2CONC2=O)CCCNC1
InChIInChI=1S/C12H21N3O3/c1-2-4-12(5-3-6-13-8-12)11(17)14-9-7-18-15-10(9)16/h9,13H,2-8H2,1H3,(H,14,17)(H,15,16)/t9-,12?/m1/s1
InChIKeyUHNLEAJEDCCENE-PKEIRNPWSA-N
MW255.32 g/mol
LogP-0.30
Rot. Bonds4

About N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-3-propylpiperidine-3-carboxamide

N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-3-propylpiperidine-3-carboxamide (PubChem CID 79523481) has the molecular formula C12H21N3O3 and a molecular weight of 255.32 g/mol. Its IUPAC name is N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-3-propylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-3-propylpiperidine-3-carboxamide
PubChem CID79523481
Molecular FormulaC12H21N3O3
Molecular Weight255.32 g/mol
Exact Mass255.16
IUPAC NameN-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-3-propylpiperidine-3-carboxamide
SMILESCCCC1(C(=O)N[C@@H]2CONC2=O)CCCNC1
InChIInChI=1S/C12H21N3O3/c1-2-4-12(5-3-6-13-8-12)11(17)14-9-7-18-15-10(9)16/h9,13H,2-8H2,1H3,(H,14,17)(H,15,16)/t9-,12?/m1/s1
InChIKeyUHNLEAJEDCCENE-PKEIRNPWSA-N
XLogP-0.30
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 5-0.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-3-propylpiperidine-3-carboxamide?
The IUPAC name of N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-3-propylpiperidine-3-carboxamide (CID 79523481) is N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-3-propylpiperidine-3-carboxamide.
What is the SMILES notation for N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-3-propylpiperidine-3-carboxamide?
The canonical SMILES for N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-3-propylpiperidine-3-carboxamide is CCCC1(C(=O)N[C@@H]2CONC2=O)CCCNC1.
What is the InChIKey of N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-3-propylpiperidine-3-carboxamide?
The InChIKey is UHNLEAJEDCCENE-PKEIRNPWSA-N. The full InChI is InChI=1S/C12H21N3O3/c1-2-4-12(5-3-6-13-8-12)11(17)14-9-7-18-15-10(9)16/h9,13H,2-8H2,1H3,(H,14,17)(H,15,16)/t9-,12?/m1/s1.
What are the key properties of N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-3-propylpiperidine-3-carboxamide?
N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-3-propylpiperidine-3-carboxamide has a molecular weight of 255.32 g/mol, XLogP of -0.30, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4R)-3-oxo-1,2-oxazolidin-4-yl]-3-propylpiperidine-3-carboxamide is sourced from PubChem (CID 79523481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).