4-(ethylaminomethyl)-N,N-bis(2-methylpropyl)-1,3-oxazol-2-amine

C14H27N3O — CID 113377666

IUPAC4-(ethylaminomethyl)-N,N-bis(2-methylpropyl)-1,3-oxazol-2-amine
SMILESCCNCc1coc(N(CC(C)C)CC(C)C)n1
InChIInChI=1S/C14H27N3O/c1-6-15-7-13-10-18-14(16-13)17(8-11(2)3)9-12(4)5/h10-12,15H,6-9H2,1-5H3
InChIKeyGKDOSWGWIRPJHO-UHFFFAOYSA-N
MW253.39 g/mol
LogP2.90
Rot. Bonds8

About 4-(ethylaminomethyl)-N,N-bis(2-methylpropyl)-1,3-oxazol-2-amine

4-(ethylaminomethyl)-N,N-bis(2-methylpropyl)-1,3-oxazol-2-amine (PubChem CID 113377666) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 4-(ethylaminomethyl)-N,N-bis(2-methylpropyl)-1,3-oxazol-2-amine.

Molecular Properties

Compound Name4-(ethylaminomethyl)-N,N-bis(2-methylpropyl)-1,3-oxazol-2-amine
PubChem CID113377666
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name4-(ethylaminomethyl)-N,N-bis(2-methylpropyl)-1,3-oxazol-2-amine
SMILESCCNCc1coc(N(CC(C)C)CC(C)C)n1
InChIInChI=1S/C14H27N3O/c1-6-15-7-13-10-18-14(16-13)17(8-11(2)3)9-12(4)5/h10-12,15H,6-9H2,1-5H3
InChIKeyGKDOSWGWIRPJHO-UHFFFAOYSA-N
XLogP2.90
TPSA41.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(ethylaminomethyl)-N,N-bis(2-methylpropyl)-1,3-oxazol-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

2-N-ethyl-2-N-[4-(ethylaminomethyl)-1,3-oxazol-2-yl]-1-N,1-N-dimethylpropane-1,2-diamine
CID 103191536
N,N-dimethyl-N'-[4-(methylaminomethyl)-1,3-oxazol-2-yl]-N'-(2-methylpropyl)ethane-1,2-diamine
CID 113377670
4-(ethylaminomethyl)-N-methyl-N-[(2-methylfuran-3-yl)methyl]-1,3-oxazol-2-amine
CID 113377754
2-(ethylaminomethyl)-N,N-bis(2-methylpropyl)pyridin-4-amine
CID 62284205
4-(ethylaminomethyl)-N-methyl-N-(thiophen-3-ylmethyl)-1,3-oxazol-2-amine
CID 113377629
N-methyl-N-(1-methylsulfanylpropan-2-yl)-4-(propylaminomethyl)-1,3-oxazol-2-amine
CID 113377887
N-[[3-(ethylaminomethyl)-1,2-oxazol-5-yl]methyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
CID 62427668
N'-[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]-N,N-dimethyl-N'-(2-methylpropyl)ethane-1,2-diamine
CID 106969906
2-N-ethyl-2-N-[4-(ethylaminomethyl)-1,3-thiazol-2-yl]-1-N,1-N-dimethylpropane-1,2-diamine
CID 103192089
6-(ethylaminomethyl)-N-(2-methylpropyl)-N-pentan-3-ylpyrazin-2-amine
CID 79488795
N-ethyl-3-(ethylaminomethyl)-4,6-dimethyl-N-(2-methylpropyl)pyridin-2-amine
CID 62280772
N-[[2-(3,4,5-trifluorophenyl)-1,3-oxazol-4-yl]methyl]ethanamine
CID 65288222

Frequently Asked Questions

What is the IUPAC name of 4-(ethylaminomethyl)-N,N-bis(2-methylpropyl)-1,3-oxazol-2-amine?
The IUPAC name of 4-(ethylaminomethyl)-N,N-bis(2-methylpropyl)-1,3-oxazol-2-amine (CID 113377666) is 4-(ethylaminomethyl)-N,N-bis(2-methylpropyl)-1,3-oxazol-2-amine.
What is the SMILES notation for 4-(ethylaminomethyl)-N,N-bis(2-methylpropyl)-1,3-oxazol-2-amine?
The canonical SMILES for 4-(ethylaminomethyl)-N,N-bis(2-methylpropyl)-1,3-oxazol-2-amine is CCNCc1coc(N(CC(C)C)CC(C)C)n1.
What is the InChIKey of 4-(ethylaminomethyl)-N,N-bis(2-methylpropyl)-1,3-oxazol-2-amine?
The InChIKey is GKDOSWGWIRPJHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-6-15-7-13-10-18-14(16-13)17(8-11(2)3)9-12(4)5/h10-12,15H,6-9H2,1-5H3.
What are the key properties of 4-(ethylaminomethyl)-N,N-bis(2-methylpropyl)-1,3-oxazol-2-amine?
4-(ethylaminomethyl)-N,N-bis(2-methylpropyl)-1,3-oxazol-2-amine has a molecular weight of 253.39 g/mol, XLogP of 2.90, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylaminomethyl)-N,N-bis(2-methylpropyl)-1,3-oxazol-2-amine is sourced from PubChem (CID 113377666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).