N,3,3-trimethyl-N-[3-(methylamino)-3-oxopropyl]piperidine-2-carboxamide

C13H25N3O2 — CID 114084347

IUPACN,3,3-trimethyl-N-[3-(methylamino)-3-oxopropyl]piperidine-2-carboxamide
SMILESCNC(=O)CCN(C)C(=O)C1NCCCC1(C)C
InChIInChI=1S/C13H25N3O2/c1-13(2)7-5-8-15-11(13)12(18)16(4)9-6-10(17)14-3/h11,15H,5-9H2,1-4H3,(H,14,17)
InChIKeyUYXAQCLFLDFWDN-UHFFFAOYSA-N
MW255.36 g/mol
LogP0.36
Rot. Bonds4

About N,3,3-trimethyl-N-[3-(methylamino)-3-oxopropyl]piperidine-2-carboxamide

N,3,3-trimethyl-N-[3-(methylamino)-3-oxopropyl]piperidine-2-carboxamide (PubChem CID 114084347) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is N,3,3-trimethyl-N-[3-(methylamino)-3-oxopropyl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN,3,3-trimethyl-N-[3-(methylamino)-3-oxopropyl]piperidine-2-carboxamide
PubChem CID114084347
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC NameN,3,3-trimethyl-N-[3-(methylamino)-3-oxopropyl]piperidine-2-carboxamide
SMILESCNC(=O)CCN(C)C(=O)C1NCCCC1(C)C
InChIInChI=1S/C13H25N3O2/c1-13(2)7-5-8-15-11(13)12(18)16(4)9-6-10(17)14-3/h11,15H,5-9H2,1-4H3,(H,14,17)
InChIKeyUYXAQCLFLDFWDN-UHFFFAOYSA-N
XLogP0.36
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,3,3-trimethyl-N-[3-(methylamino)-3-oxopropyl]piperidine-2-carboxamide?
The IUPAC name of N,3,3-trimethyl-N-[3-(methylamino)-3-oxopropyl]piperidine-2-carboxamide (CID 114084347) is N,3,3-trimethyl-N-[3-(methylamino)-3-oxopropyl]piperidine-2-carboxamide.
What is the SMILES notation for N,3,3-trimethyl-N-[3-(methylamino)-3-oxopropyl]piperidine-2-carboxamide?
The canonical SMILES for N,3,3-trimethyl-N-[3-(methylamino)-3-oxopropyl]piperidine-2-carboxamide is CNC(=O)CCN(C)C(=O)C1NCCCC1(C)C.
What is the InChIKey of N,3,3-trimethyl-N-[3-(methylamino)-3-oxopropyl]piperidine-2-carboxamide?
The InChIKey is UYXAQCLFLDFWDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-13(2)7-5-8-15-11(13)12(18)16(4)9-6-10(17)14-3/h11,15H,5-9H2,1-4H3,(H,14,17).
What are the key properties of N,3,3-trimethyl-N-[3-(methylamino)-3-oxopropyl]piperidine-2-carboxamide?
N,3,3-trimethyl-N-[3-(methylamino)-3-oxopropyl]piperidine-2-carboxamide has a molecular weight of 255.36 g/mol, XLogP of 0.36, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,3,3-trimethyl-N-[3-(methylamino)-3-oxopropyl]piperidine-2-carboxamide is sourced from PubChem (CID 114084347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).