N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-propan-2-ylpyrrolidine-3-carboxamide

C14H23N3O2 — CID 106979778

IUPACN-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-propan-2-ylpyrrolidine-3-carboxamide
SMILESCc1cc(CN(C)C(=O)C2(C(C)C)CCNC2)no1
InChIInChI=1S/C14H23N3O2/c1-10(2)14(5-6-15-9-14)13(18)17(4)8-12-7-11(3)19-16-12/h7,10,15H,5-6,8-9H2,1-4H3
InChIKeyIEMOCBMHROFOQB-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.58
Rot. Bonds4

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

N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-propan-2-ylpyrrolidine-3-carboxamide (PubChem CID 106979778) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-propan-2-ylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-propan-2-ylpyrrolidine-3-carboxamide
PubChem CID106979778
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC NameN-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-propan-2-ylpyrrolidine-3-carboxamide
SMILESCc1cc(CN(C)C(=O)C2(C(C)C)CCNC2)no1
InChIInChI=1S/C14H23N3O2/c1-10(2)14(5-6-15-9-14)13(18)17(4)8-12-7-11(3)19-16-12/h7,10,15H,5-6,8-9H2,1-4H3
InChIKeyIEMOCBMHROFOQB-UHFFFAOYSA-N
XLogP1.58
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-[(1-methylimidazol-2-yl)methyl]-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106980175
N-methyl-3-propan-2-yl-N-(1H-pyrazol-4-ylmethyl)pyrrolidine-3-carboxamide
CID 106980739
1-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]cyclobutane-1-carboxamide
CID 81178859
N-[(3,4-difluorophenyl)methyl]-N-methyl-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106980069
N-methyl-N-(2-methylpropyl)-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106979682
N-[(2-chloro-6-fluorophenyl)methyl]-N-methyl-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106980027
2-amino-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propanamide
CID 43588863
N-methyl-3-propan-2-yl-N-(2-pyridin-4-ylethyl)pyrrolidine-3-carboxamide
CID 106979980
N-methyl-1-(5-methyl-1,2-oxazol-3-yl)-N-[(3-methylpyrrolidin-3-yl)methyl]methanamine
CID 120898715
N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-N-methyl-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106980151
N-methyl-N-(2-phenoxyethyl)-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106980020
N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-2-(2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)acetamide
CID 72906523

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-propan-2-ylpyrrolidine-3-carboxamide?
The IUPAC name of N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-propan-2-ylpyrrolidine-3-carboxamide (CID 106979778) is N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-propan-2-ylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-propan-2-ylpyrrolidine-3-carboxamide?
The canonical SMILES for N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-propan-2-ylpyrrolidine-3-carboxamide is Cc1cc(CN(C)C(=O)C2(C(C)C)CCNC2)no1.
What is the InChIKey of N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-propan-2-ylpyrrolidine-3-carboxamide?
The InChIKey is IEMOCBMHROFOQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-10(2)14(5-6-15-9-14)13(18)17(4)8-12-7-11(3)19-16-12/h7,10,15H,5-6,8-9H2,1-4H3.
What are the key properties of N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-propan-2-ylpyrrolidine-3-carboxamide?
N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-propan-2-ylpyrrolidine-3-carboxamide has a molecular weight of 265.36 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-3-propan-2-ylpyrrolidine-3-carboxamide is sourced from PubChem (CID 106979778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).