(2R)-2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]pyrrolidine-1-carboxamide

C15H21N5O2 — CID 94121216

IUPAC(2R)-2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]pyrrolidine-1-carboxamide
SMILESCc1cc([C@H]2CCCN2C(=O)NCCc2cnn(C)c2)on1
InChIInChI=1S/C15H21N5O2/c1-11-8-14(22-18-11)13-4-3-7-20(13)15(21)16-6-5-12-9-17-19(2)10-12/h8-10,13H,3-7H2,1-2H3,(H,16,21)/t13-/m1/s1
InChIKeyURNXIOKLUMHGGV-CYBMUJFWSA-N
MW303.37 g/mol
LogP1.81
Rot. Bonds4

About (2R)-2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]pyrrolidine-1-carboxamide

(2R)-2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]pyrrolidine-1-carboxamide (PubChem CID 94121216) has the molecular formula C15H21N5O2 and a molecular weight of 303.37 g/mol. Its IUPAC name is (2R)-2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name(2R)-2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]pyrrolidine-1-carboxamide
PubChem CID94121216
Molecular FormulaC15H21N5O2
Molecular Weight303.37 g/mol
Exact Mass303.17
IUPAC Name(2R)-2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]pyrrolidine-1-carboxamide
SMILESCc1cc([C@H]2CCCN2C(=O)NCCc2cnn(C)c2)on1
InChIInChI=1S/C15H21N5O2/c1-11-8-14(22-18-11)13-4-3-7-20(13)15(21)16-6-5-12-9-17-19(2)10-12/h8-10,13H,3-7H2,1-2H3,(H,16,21)/t13-/m1/s1
InChIKeyURNXIOKLUMHGGV-CYBMUJFWSA-N
XLogP1.81
TPSA76.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]pyrrolidine-1-carboxamide?
The IUPAC name of (2R)-2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]pyrrolidine-1-carboxamide (CID 94121216) is (2R)-2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for (2R)-2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]pyrrolidine-1-carboxamide?
The canonical SMILES for (2R)-2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]pyrrolidine-1-carboxamide is Cc1cc([C@H]2CCCN2C(=O)NCCc2cnn(C)c2)on1.
What is the InChIKey of (2R)-2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]pyrrolidine-1-carboxamide?
The InChIKey is URNXIOKLUMHGGV-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H21N5O2/c1-11-8-14(22-18-11)13-4-3-7-20(13)15(21)16-6-5-12-9-17-19(2)10-12/h8-10,13H,3-7H2,1-2H3,(H,16,21)/t13-/m1/s1.
What are the key properties of (2R)-2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]pyrrolidine-1-carboxamide?
(2R)-2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]pyrrolidine-1-carboxamide has a molecular weight of 303.37 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(3-methyl-1,2-oxazol-5-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 94121216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).