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

C11H17N3O2 — CID 103822240

IUPAC4-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidine-3-carboxamide
SMILESCc1cnc(CNC(=O)C2CNCC2C)o1
InChIInChI=1S/C11H17N3O2/c1-7-3-12-5-9(7)11(15)14-6-10-13-4-8(2)16-10/h4,7,9,12H,3,5-6H2,1-2H3,(H,14,15)
InChIKeyDLWHIJRRPWXLQH-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.45
Rot. Bonds3

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

4-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidine-3-carboxamide (PubChem CID 103822240) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 4-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name4-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidine-3-carboxamide
PubChem CID103822240
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name4-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidine-3-carboxamide
SMILESCc1cnc(CNC(=O)C2CNCC2C)o1
InChIInChI=1S/C11H17N3O2/c1-7-3-12-5-9(7)11(15)14-6-10-13-4-8(2)16-10/h4,7,9,12H,3,5-6H2,1-2H3,(H,14,15)
InChIKeyDLWHIJRRPWXLQH-UHFFFAOYSA-N
XLogP0.45
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 ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-methylpyrrolidine-3-carboxamide
CID 106371116
4-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrolidine-3-carboxamide
CID 63714175
(3S,4S)-1-benzyl-4-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidine-3-carboxamide
CID 128984998
2-(3,4-difluorophenyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]cyclopropane-1-carboxamide
CID 71863788
N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-4-methylpyrrolidine-3-carboxamide
CID 103822331
trans-(1S,2S)-2-(3-methoxyphenyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]cyclopropane-1-carboxamide
CID 95784712
(2S,3S)-2-(4-fluorophenyl)-1-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 125135854
2-(azetidin-3-ylidene)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]propanamide
CID 106371486
1-ethyl-3-[(5-methyl-1,3-oxazol-2-yl)methyl]urea
CID 103738715
2-amino-N-[(5-methyl-1,3-oxazol-2-yl)methyl]acetamide
CID 83622965
1-cyclohexyl-3-[(5-methyl-1,3-oxazol-2-yl)methyl]urea
CID 110660494
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-sulfanylpropanamide
CID 106377758

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidine-3-carboxamide?
The IUPAC name of 4-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidine-3-carboxamide (CID 103822240) is 4-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidine-3-carboxamide.
What is the SMILES notation for 4-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidine-3-carboxamide?
The canonical SMILES for 4-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidine-3-carboxamide is Cc1cnc(CNC(=O)C2CNCC2C)o1.
What is the InChIKey of 4-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidine-3-carboxamide?
The InChIKey is DLWHIJRRPWXLQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-7-3-12-5-9(7)11(15)14-6-10-13-4-8(2)16-10/h4,7,9,12H,3,5-6H2,1-2H3,(H,14,15).
What are the key properties of 4-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidine-3-carboxamide?
4-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidine-3-carboxamide has a molecular weight of 223.28 g/mol, XLogP of 0.45, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidine-3-carboxamide is sourced from PubChem (CID 103822240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).