N-pentyl-1,3-oxazol-5-amine

C8H14N2O — CID 70629881

IUPACN-pentyl-1,3-oxazol-5-amine
SMILESCCCCCNc1cnco1
InChIInChI=1S/C8H14N2O/c1-2-3-4-5-10-8-6-9-7-11-8/h6-7,10H,2-5H2,1H3
InChIKeyHNVZUAWOPIZESA-UHFFFAOYSA-N
MW154.21 g/mol
LogP2.28
Rot. Bonds5

About N-pentyl-1,3-oxazol-5-amine

N-pentyl-1,3-oxazol-5-amine (PubChem CID 70629881) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is N-pentyl-1,3-oxazol-5-amine.

Molecular Properties

Compound NameN-pentyl-1,3-oxazol-5-amine
PubChem CID70629881
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC NameN-pentyl-1,3-oxazol-5-amine
SMILESCCCCCNc1cnco1
InChIInChI=1S/C8H14N2O/c1-2-3-4-5-10-8-6-9-7-11-8/h6-7,10H,2-5H2,1H3
InChIKeyHNVZUAWOPIZESA-UHFFFAOYSA-N
XLogP2.28
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-pentyl-1,3-oxazol-5-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-pentyl-1,3-oxazol-5-amine?
The IUPAC name of N-pentyl-1,3-oxazol-5-amine (CID 70629881) is N-pentyl-1,3-oxazol-5-amine.
What is the SMILES notation for N-pentyl-1,3-oxazol-5-amine?
The canonical SMILES for N-pentyl-1,3-oxazol-5-amine is CCCCCNc1cnco1.
What is the InChIKey of N-pentyl-1,3-oxazol-5-amine?
The InChIKey is HNVZUAWOPIZESA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-2-3-4-5-10-8-6-9-7-11-8/h6-7,10H,2-5H2,1H3.
What are the key properties of N-pentyl-1,3-oxazol-5-amine?
N-pentyl-1,3-oxazol-5-amine has a molecular weight of 154.21 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentyl-1,3-oxazol-5-amine is sourced from PubChem (CID 70629881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).