N-cyclohexyl-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide

C15H23N3O2 — CID 50946091

IUPACN-cyclohexyl-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide
SMILESCc1cc(C2CCCN2C(=O)NC2CCCCC2)no1
InChIInChI=1S/C15H23N3O2/c1-11-10-13(17-20-11)14-8-5-9-18(14)15(19)16-12-6-3-2-4-7-12/h10,12,14H,2-9H2,1H3,(H,16,19)
InChIKeyFITQZJZMKQQPQS-UHFFFAOYSA-N
MW277.37 g/mol
LogP3.16
Rot. Bonds2

About N-cyclohexyl-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide

N-cyclohexyl-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide (PubChem CID 50946091) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-cyclohexyl-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide
PubChem CID50946091
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-cyclohexyl-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide
SMILESCc1cc(C2CCCN2C(=O)NC2CCCCC2)no1
InChIInChI=1S/C15H23N3O2/c1-11-10-13(17-20-11)14-8-5-9-18(14)15(19)16-12-6-3-2-4-7-12/h10,12,14H,2-9H2,1H3,(H,16,19)
InChIKeyFITQZJZMKQQPQS-UHFFFAOYSA-N
XLogP3.16
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide?
The IUPAC name of N-cyclohexyl-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide (CID 50946091) is N-cyclohexyl-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-cyclohexyl-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide is Cc1cc(C2CCCN2C(=O)NC2CCCCC2)no1.
What is the InChIKey of N-cyclohexyl-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide?
The InChIKey is FITQZJZMKQQPQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-11-10-13(17-20-11)14-8-5-9-18(14)15(19)16-12-6-3-2-4-7-12/h10,12,14H,2-9H2,1H3,(H,16,19).
What are the key properties of N-cyclohexyl-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide?
N-cyclohexyl-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 3.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 50946091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).