N-[(4-methyl-1,3-oxazol-5-yl)methyl]piperidine-3-carboxamide

C11H17N3O2 — CID 83631129

IUPACN-[(4-methyl-1,3-oxazol-5-yl)methyl]piperidine-3-carboxamide
SMILESCc1ncoc1CNC(=O)C1CCCNC1
InChIInChI=1S/C11H17N3O2/c1-8-10(16-7-14-8)6-13-11(15)9-3-2-4-12-5-9/h7,9,12H,2-6H2,1H3,(H,13,15)
InChIKeyNXASFCYUGILTEO-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.60
Rot. Bonds3

About N-[(4-methyl-1,3-oxazol-5-yl)methyl]piperidine-3-carboxamide

N-[(4-methyl-1,3-oxazol-5-yl)methyl]piperidine-3-carboxamide (PubChem CID 83631129) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is N-[(4-methyl-1,3-oxazol-5-yl)methyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-[(4-methyl-1,3-oxazol-5-yl)methyl]piperidine-3-carboxamide
PubChem CID83631129
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC NameN-[(4-methyl-1,3-oxazol-5-yl)methyl]piperidine-3-carboxamide
SMILESCc1ncoc1CNC(=O)C1CCCNC1
InChIInChI=1S/C11H17N3O2/c1-8-10(16-7-14-8)6-13-11(15)9-3-2-4-12-5-9/h7,9,12H,2-6H2,1H3,(H,13,15)
InChIKeyNXASFCYUGILTEO-UHFFFAOYSA-N
XLogP0.60
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(4-methyl-1,3-oxazol-5-yl)methyl]piperidine-3-carboxamide?
The IUPAC name of N-[(4-methyl-1,3-oxazol-5-yl)methyl]piperidine-3-carboxamide (CID 83631129) is N-[(4-methyl-1,3-oxazol-5-yl)methyl]piperidine-3-carboxamide.
What is the SMILES notation for N-[(4-methyl-1,3-oxazol-5-yl)methyl]piperidine-3-carboxamide?
The canonical SMILES for N-[(4-methyl-1,3-oxazol-5-yl)methyl]piperidine-3-carboxamide is Cc1ncoc1CNC(=O)C1CCCNC1.
What is the InChIKey of N-[(4-methyl-1,3-oxazol-5-yl)methyl]piperidine-3-carboxamide?
The InChIKey is NXASFCYUGILTEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-8-10(16-7-14-8)6-13-11(15)9-3-2-4-12-5-9/h7,9,12H,2-6H2,1H3,(H,13,15).
What are the key properties of N-[(4-methyl-1,3-oxazol-5-yl)methyl]piperidine-3-carboxamide?
N-[(4-methyl-1,3-oxazol-5-yl)methyl]piperidine-3-carboxamide has a molecular weight of 223.28 g/mol, XLogP of 0.60, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methyl-1,3-oxazol-5-yl)methyl]piperidine-3-carboxamide is sourced from PubChem (CID 83631129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).