N-ethyl-3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propan-1-amine

C14H22N4O — CID 66120498

IUPACN-ethyl-3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propan-1-amine
SMILESCCNCCCc1ncc(-c2cc(C)nn2CC)o1
InChIInChI=1S/C14H22N4O/c1-4-15-8-6-7-14-16-10-13(19-14)12-9-11(3)17-18(12)5-2/h9-10,15H,4-8H2,1-3H3
InChIKeyBFCPXDQXHIFOSZ-UHFFFAOYSA-N
MW262.36 g/mol
LogP2.41
Rot. Bonds7

About N-ethyl-3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propan-1-amine

N-ethyl-3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propan-1-amine (PubChem CID 66120498) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is N-ethyl-3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propan-1-amine.

Molecular Properties

Compound NameN-ethyl-3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propan-1-amine
PubChem CID66120498
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC NameN-ethyl-3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propan-1-amine
SMILESCCNCCCc1ncc(-c2cc(C)nn2CC)o1
InChIInChI=1S/C14H22N4O/c1-4-15-8-6-7-14-16-10-13(19-14)12-9-11(3)17-18(12)5-2/h9-10,15H,4-8H2,1-3H3
InChIKeyBFCPXDQXHIFOSZ-UHFFFAOYSA-N
XLogP2.41
TPSA55.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-ethyl-3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]-N-(2-methoxyethyl)propan-1-amine
CID 66120896
N-[3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propyl]cyclopropanamine
CID 66120698
N-[2-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]ethyl]propan-2-amine
CID 66120101
N-[2-[5-(1,3-diethylpyrazol-5-yl)-1,3-oxazol-2-yl]ethyl]propan-1-amine
CID 66120641
3-[5-(3-bromo-4-methylphenyl)-1,3-oxazol-2-yl]-N-ethylpropan-1-amine
CID 81488018
2-(3-chloropropyl)-5-(2,5-dimethylpyrazol-3-yl)-1,3-oxazole
CID 66127379
3-[5-(3-chloro-4-methylphenyl)-1,3-oxazol-2-yl]-N-ethylpropan-1-amine
CID 65187301
3-[5-(3-bromo-5-chlorophenyl)-1,3-oxazol-2-yl]-N-ethylpropan-1-amine
CID 107941923
N-ethyl-3-[5-(3-methylthiophen-2-yl)-1,3-oxazol-2-yl]propan-1-amine
CID 65186772
N-ethyl-3-[5-(2-methyl-4-nitrophenyl)-1,3-oxazol-2-yl]propan-1-amine
CID 65186815
3-[5-(2,4-dichlorophenyl)-1,3-oxazol-2-yl]-N-ethylpropan-1-amine
CID 65187402
3-[5-(2-methylpyrazol-3-yl)-1,3-oxazol-2-yl]-N-propylpropan-1-amine
CID 65187169

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propan-1-amine?
The IUPAC name of N-ethyl-3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propan-1-amine (CID 66120498) is N-ethyl-3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propan-1-amine.
What is the SMILES notation for N-ethyl-3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propan-1-amine?
The canonical SMILES for N-ethyl-3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propan-1-amine is CCNCCCc1ncc(-c2cc(C)nn2CC)o1.
What is the InChIKey of N-ethyl-3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propan-1-amine?
The InChIKey is BFCPXDQXHIFOSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-4-15-8-6-7-14-16-10-13(19-14)12-9-11(3)17-18(12)5-2/h9-10,15H,4-8H2,1-3H3.
What are the key properties of N-ethyl-3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propan-1-amine?
N-ethyl-3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propan-1-amine has a molecular weight of 262.36 g/mol, XLogP of 2.41, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-[5-(2-ethyl-5-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propan-1-amine is sourced from PubChem (CID 66120498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).