N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyrrolidin-2-ylpropan-2-amine

C13H23N3O — CID 114179950

IUPACN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyrrolidin-2-ylpropan-2-amine
SMILESCCc1cnc(CNC(C)CC2CCCN2)o1
InChIInChI=1S/C13H23N3O/c1-3-12-8-16-13(17-12)9-15-10(2)7-11-5-4-6-14-11/h8,10-11,14-15H,3-7,9H2,1-2H3
InChIKeyMJZNIWCVVZPPRV-UHFFFAOYSA-N
MW237.35 g/mol
LogP1.86
Rot. Bonds6

About N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyrrolidin-2-ylpropan-2-amine

N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyrrolidin-2-ylpropan-2-amine (PubChem CID 114179950) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyrrolidin-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyrrolidin-2-ylpropan-2-amine
PubChem CID114179950
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC NameN-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyrrolidin-2-ylpropan-2-amine
SMILESCCc1cnc(CNC(C)CC2CCCN2)o1
InChIInChI=1S/C13H23N3O/c1-3-12-8-16-13(17-12)9-15-10(2)7-11-5-4-6-14-11/h8,10-11,14-15H,3-7,9H2,1-2H3
InChIKeyMJZNIWCVVZPPRV-UHFFFAOYSA-N
XLogP1.86
TPSA50.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(5-methylpyrazin-2-yl)methyl]-1-pyrrolidin-2-ylpropan-2-amine
CID 79540310
N-(1,2-oxazol-5-ylmethyl)-1-pyrrolidin-2-ylpropan-2-amine
CID 106415263
N-[(5-methyl-1,2-oxazol-3-yl)methyl]-1-pyrrolidin-2-ylpropan-2-amine
CID 79541452
N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-1-piperidin-2-ylpropan-2-amine
CID 79535946
N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-1-pyrrolidin-2-ylpropan-2-amine
CID 112668454
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(1-methylcyclopropyl)ethanamine
CID 106369024
1-(azepan-2-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)propan-2-amine
CID 79560554
3-[(5-ethyl-1,3-oxazol-2-yl)methylamino]-2-methylbutan-2-ol
CID 106368581
1-(azepan-2-yl)-N-[(6-methoxy-3-pyridinyl)methyl]propan-2-amine
CID 79560021
N-[(4-methylphenyl)methyl]-1-piperidin-2-ylpropan-2-amine
CID 79548722
2-[(5-ethyl-1,3-oxazol-2-yl)methylamino]-N-pentan-2-ylpropanamide
CID 106370877
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]piperidine-4-carboxamide
CID 106371216

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyrrolidin-2-ylpropan-2-amine?
The IUPAC name of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyrrolidin-2-ylpropan-2-amine (CID 114179950) is N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyrrolidin-2-ylpropan-2-amine.
What is the SMILES notation for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyrrolidin-2-ylpropan-2-amine?
The canonical SMILES for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyrrolidin-2-ylpropan-2-amine is CCc1cnc(CNC(C)CC2CCCN2)o1.
What is the InChIKey of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyrrolidin-2-ylpropan-2-amine?
The InChIKey is MJZNIWCVVZPPRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-3-12-8-16-13(17-12)9-15-10(2)7-11-5-4-6-14-11/h8,10-11,14-15H,3-7,9H2,1-2H3.
What are the key properties of N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyrrolidin-2-ylpropan-2-amine?
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyrrolidin-2-ylpropan-2-amine has a molecular weight of 237.35 g/mol, XLogP of 1.86, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-pyrrolidin-2-ylpropan-2-amine is sourced from PubChem (CID 114179950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).