N,3-dimethyl-5-(3-methylpentan-3-yl)-1,2-oxazol-4-amine

C11H20N2O — CID 135170478

IUPACN,3-dimethyl-5-(3-methylpentan-3-yl)-1,2-oxazol-4-amine
SMILESCCC(C)(CC)c1onc(C)c1NC
InChIInChI=1S/C11H20N2O/c1-6-11(4,7-2)10-9(12-5)8(3)13-14-10/h12H,6-7H2,1-5H3
InChIKeyPXOWOVFCDZZQDR-UHFFFAOYSA-N
MW196.29 g/mol
LogP3.10
Rot. Bonds4

About N,3-dimethyl-5-(3-methylpentan-3-yl)-1,2-oxazol-4-amine

N,3-dimethyl-5-(3-methylpentan-3-yl)-1,2-oxazol-4-amine (PubChem CID 135170478) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is N,3-dimethyl-5-(3-methylpentan-3-yl)-1,2-oxazol-4-amine.

Molecular Properties

Compound NameN,3-dimethyl-5-(3-methylpentan-3-yl)-1,2-oxazol-4-amine
PubChem CID135170478
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC NameN,3-dimethyl-5-(3-methylpentan-3-yl)-1,2-oxazol-4-amine
SMILESCCC(C)(CC)c1onc(C)c1NC
InChIInChI=1S/C11H20N2O/c1-6-11(4,7-2)10-9(12-5)8(3)13-14-10/h12H,6-7H2,1-5H3
InChIKeyPXOWOVFCDZZQDR-UHFFFAOYSA-N
XLogP3.10
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dimethyl-4-(3-methylpentan-3-yl)-1,2-oxazole
CID 129201550
3,5-dimethyl-N-(2-methylbutan-2-yl)-1,2-oxazol-4-amine
CID 155244298
N-decyl-3,5-dimethyl-1,2-oxazol-4-amine
CID 150808567
4-bromo-5-tert-butyl-3-methyl-1,2-oxazole
CID 135170621
3,5-dimethyl-4-(7-methyltetradecan-7-yl)-1,2-oxazole
CID 137470392
tert-butyl N-(5-amino-3-methyl-1,2-oxazol-4-yl)carbamate
CID 117274287
5-N,3-dimethyl-1,2-oxazole-4,5-diamine
CID 118227876
3,5-dimethyl-N-(1H-pyrrol-2-ylmethyl)-1,2-oxazol-4-amine
CID 131209113
4-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-N-methyl-5-propan-2-ylpyrimidine-4,6-diamine
CID 80848891
N-butyl-3,4-dimethyl-1,2-oxazol-5-amine
CID 154191592
3-(2,2-dimethylbutyl)-5-methyl-1,2-oxazole
CID 155129451
N-(1-chloro-2-methylbutan-2-yl)-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 65032564

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-5-(3-methylpentan-3-yl)-1,2-oxazol-4-amine?
The IUPAC name of N,3-dimethyl-5-(3-methylpentan-3-yl)-1,2-oxazol-4-amine (CID 135170478) is N,3-dimethyl-5-(3-methylpentan-3-yl)-1,2-oxazol-4-amine.
What is the SMILES notation for N,3-dimethyl-5-(3-methylpentan-3-yl)-1,2-oxazol-4-amine?
The canonical SMILES for N,3-dimethyl-5-(3-methylpentan-3-yl)-1,2-oxazol-4-amine is CCC(C)(CC)c1onc(C)c1NC.
What is the InChIKey of N,3-dimethyl-5-(3-methylpentan-3-yl)-1,2-oxazol-4-amine?
The InChIKey is PXOWOVFCDZZQDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-6-11(4,7-2)10-9(12-5)8(3)13-14-10/h12H,6-7H2,1-5H3.
What are the key properties of N,3-dimethyl-5-(3-methylpentan-3-yl)-1,2-oxazol-4-amine?
N,3-dimethyl-5-(3-methylpentan-3-yl)-1,2-oxazol-4-amine has a molecular weight of 196.29 g/mol, XLogP of 3.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-5-(3-methylpentan-3-yl)-1,2-oxazol-4-amine is sourced from PubChem (CID 135170478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).