N-[(5-butyl-1,3-oxazol-2-yl)methyl]propan-2-amine

C11H20N2O — CID 65184198

IUPACN-[(5-butyl-1,3-oxazol-2-yl)methyl]propan-2-amine
SMILESCCCCc1cnc(CNC(C)C)o1
InChIInChI=1S/C11H20N2O/c1-4-5-6-10-7-13-11(14-10)8-12-9(2)3/h7,9,12H,4-6,8H2,1-3H3
InChIKeyNKQXOAWVPOJOON-UHFFFAOYSA-N
MW196.29 g/mol
LogP2.52
Rot. Bonds6

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

N-[(5-butyl-1,3-oxazol-2-yl)methyl]propan-2-amine (PubChem CID 65184198) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is N-[(5-butyl-1,3-oxazol-2-yl)methyl]propan-2-amine.

Molecular Properties

Compound NameN-[(5-butyl-1,3-oxazol-2-yl)methyl]propan-2-amine
PubChem CID65184198
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC NameN-[(5-butyl-1,3-oxazol-2-yl)methyl]propan-2-amine
SMILESCCCCc1cnc(CNC(C)C)o1
InChIInChI=1S/C11H20N2O/c1-4-5-6-10-7-13-11(14-10)8-12-9(2)3/h7,9,12H,4-6,8H2,1-3H3
InChIKeyNKQXOAWVPOJOON-UHFFFAOYSA-N
XLogP2.52
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(5-butyl-1,3-oxazol-2-yl)methyl]propan-2-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

N-[[5-(ethoxymethyl)-1,3-oxazol-2-yl]methyl]propan-2-amine
CID 65184149
1-(4-butylphenyl)-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]ethanamine
CID 106368810
2,5-dipentyl-1,3-oxazole
CID 67264472
N-[[5-(3-methylbutyl)-1,3-oxazol-2-yl]methyl]propan-1-amine
CID 65184333
N-[(5-propyl-1,3-oxazol-2-yl)methyl]propan-1-amine
CID 65184036
N-[(5-nonyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine
CID 65427375
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butan-1-amine
CID 106369292
2-(5-butyl-1,3-oxazol-2-yl)-N-(2-methoxyethyl)ethanamine
CID 65182423
N-[(5-methyl-1,3-oxazol-2-yl)methyl]hexan-2-amine
CID 103096842
3-[5-(2,2-dimethylpropyl)-1,3-oxazol-2-yl]-N-propan-2-ylpropan-1-amine
CID 65187329
N-[2-[5-(2-methoxyethyl)-1,3-oxazol-2-yl]ethyl]propan-2-amine
CID 65182920
3-[(5-ethyl-1,3-oxazol-2-yl)methylamino]-2-methylbutan-2-ol
CID 106368581

Frequently Asked Questions

What is the IUPAC name of N-[(5-butyl-1,3-oxazol-2-yl)methyl]propan-2-amine?
The IUPAC name of N-[(5-butyl-1,3-oxazol-2-yl)methyl]propan-2-amine (CID 65184198) is N-[(5-butyl-1,3-oxazol-2-yl)methyl]propan-2-amine.
What is the SMILES notation for N-[(5-butyl-1,3-oxazol-2-yl)methyl]propan-2-amine?
The canonical SMILES for N-[(5-butyl-1,3-oxazol-2-yl)methyl]propan-2-amine is CCCCc1cnc(CNC(C)C)o1.
What is the InChIKey of N-[(5-butyl-1,3-oxazol-2-yl)methyl]propan-2-amine?
The InChIKey is NKQXOAWVPOJOON-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-4-5-6-10-7-13-11(14-10)8-12-9(2)3/h7,9,12H,4-6,8H2,1-3H3.
What are the key properties of N-[(5-butyl-1,3-oxazol-2-yl)methyl]propan-2-amine?
N-[(5-butyl-1,3-oxazol-2-yl)methyl]propan-2-amine has a molecular weight of 196.29 g/mol, XLogP of 2.52, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-butyl-1,3-oxazol-2-yl)methyl]propan-2-amine is sourced from PubChem (CID 65184198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).