(2S)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]piperidine-2-carboxamide

C13H21N3O2 — CID 103811457

IUPAC(2S)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]piperidine-2-carboxamide
SMILESCc1noc(C)c1C(C)NC(=O)[C@@H]1CCCCN1
InChIInChI=1S/C13H21N3O2/c1-8(12-9(2)16-18-10(12)3)15-13(17)11-6-4-5-7-14-11/h8,11,14H,4-7H2,1-3H3,(H,15,17)/t8?,11-/m0/s1
InChIKeyFGBVOKHQNYUVLT-LYNSQETBSA-N
MW251.33 g/mol
LogP1.61
Rot. Bonds3

About (2S)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]piperidine-2-carboxamide

(2S)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]piperidine-2-carboxamide (PubChem CID 103811457) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is (2S)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]piperidine-2-carboxamide
PubChem CID103811457
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC Name(2S)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]piperidine-2-carboxamide
SMILESCc1noc(C)c1C(C)NC(=O)[C@@H]1CCCCN1
InChIInChI=1S/C13H21N3O2/c1-8(12-9(2)16-18-10(12)3)15-13(17)11-6-4-5-7-14-11/h8,11,14H,4-7H2,1-3H3,(H,15,17)/t8?,11-/m0/s1
InChIKeyFGBVOKHQNYUVLT-LYNSQETBSA-N
XLogP1.61
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (2S)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]piperidine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119310286
N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]piperidine-2-carboxamide
CID 114182398
1-(azepan-2-yl)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]propan-2-amine
CID 79559984
N-[(1S)-1-(4-methylphenyl)ethyl]piperidine-2-carboxamide
CID 81355602
(2R)-N-[1-(1H-imidazol-2-yl)ethyl]piperidine-2-carboxamide
CID 104914789
(2S)-N-[1-(1H-imidazol-2-yl)ethyl]piperidine-2-carboxamide
CID 104914790
N-[(1R)-1-pyridin-4-ylethyl]piperidine-2-carboxamide
CID 81410506
N-[(1S)-1-phenylethyl]piperidine-2-carboxamide
CID 15445575
(2S)-N-[(1S)-1-(furan-2-yl)ethyl]piperidine-2-carboxamide
CID 93104490
(2R)-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-2-carboxamide
CID 113267552
1-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3-methylurea
CID 115626660
(2S)-N-[1-(4-fluorophenyl)ethyl]piperidine-2-carboxamide
CID 75495928

Frequently Asked Questions

What is the IUPAC name of (2S)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]piperidine-2-carboxamide?
The IUPAC name of (2S)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]piperidine-2-carboxamide (CID 103811457) is (2S)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]piperidine-2-carboxamide.
What is the SMILES notation for (2S)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]piperidine-2-carboxamide?
The canonical SMILES for (2S)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]piperidine-2-carboxamide is Cc1noc(C)c1C(C)NC(=O)[C@@H]1CCCCN1.
What is the InChIKey of (2S)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]piperidine-2-carboxamide?
The InChIKey is FGBVOKHQNYUVLT-LYNSQETBSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-8(12-9(2)16-18-10(12)3)15-13(17)11-6-4-5-7-14-11/h8,11,14H,4-7H2,1-3H3,(H,15,17)/t8?,11-/m0/s1.
What are the key properties of (2S)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]piperidine-2-carboxamide?
(2S)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]piperidine-2-carboxamide has a molecular weight of 251.33 g/mol, XLogP of 1.61, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]piperidine-2-carboxamide is sourced from PubChem (CID 103811457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).