N-methyl-1-[2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]piperidine-4-carboxamide

C15H24N4O3 — CID 31688805

IUPACN-methyl-1-[2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]piperidine-4-carboxamide
SMILESCNC(=O)C1CCN(CC(=O)Nc2cc(C(C)C)no2)CC1
InChIInChI=1S/C15H24N4O3/c1-10(2)12-8-14(22-18-12)17-13(20)9-19-6-4-11(5-7-19)15(21)16-3/h8,10-11H,4-7,9H2,1-3H3,(H,16,21)(H,17,20)
InChIKeyMCUPBEGBGBCCED-UHFFFAOYSA-N
MW308.38 g/mol
LogP1.19
Rot. Bonds5

About N-methyl-1-[2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]piperidine-4-carboxamide

N-methyl-1-[2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]piperidine-4-carboxamide (PubChem CID 31688805) has the molecular formula C15H24N4O3 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-methyl-1-[2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-methyl-1-[2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]piperidine-4-carboxamide
PubChem CID31688805
Molecular FormulaC15H24N4O3
Molecular Weight308.38 g/mol
Exact Mass308.18
IUPAC NameN-methyl-1-[2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]piperidine-4-carboxamide
SMILESCNC(=O)C1CCN(CC(=O)Nc2cc(C(C)C)no2)CC1
InChIInChI=1S/C15H24N4O3/c1-10(2)12-8-14(22-18-12)17-13(20)9-19-6-4-11(5-7-19)15(21)16-3/h8,10-11H,4-7,9H2,1-3H3,(H,16,21)(H,17,20)
InChIKeyMCUPBEGBGBCCED-UHFFFAOYSA-N
XLogP1.19
TPSA87.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]piperidine-4-carboxamide?
The IUPAC name of N-methyl-1-[2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]piperidine-4-carboxamide (CID 31688805) is N-methyl-1-[2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]piperidine-4-carboxamide.
What is the SMILES notation for N-methyl-1-[2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]piperidine-4-carboxamide?
The canonical SMILES for N-methyl-1-[2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]piperidine-4-carboxamide is CNC(=O)C1CCN(CC(=O)Nc2cc(C(C)C)no2)CC1.
What is the InChIKey of N-methyl-1-[2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]piperidine-4-carboxamide?
The InChIKey is MCUPBEGBGBCCED-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O3/c1-10(2)12-8-14(22-18-12)17-13(20)9-19-6-4-11(5-7-19)15(21)16-3/h8,10-11H,4-7,9H2,1-3H3,(H,16,21)(H,17,20).
What are the key properties of N-methyl-1-[2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]piperidine-4-carboxamide?
N-methyl-1-[2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]piperidine-4-carboxamide has a molecular weight of 308.38 g/mol, XLogP of 1.19, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]piperidine-4-carboxamide is sourced from PubChem (CID 31688805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).