N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methylbutanamide

C11H18N2O2 — CID 47861597

IUPACN-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methylbutanamide
SMILESCc1noc(C)c1CNC(=O)CC(C)C
InChIInChI=1S/C11H18N2O2/c1-7(2)5-11(14)12-6-10-8(3)13-15-9(10)4/h7H,5-6H2,1-4H3,(H,12,14)
InChIKeyFGMFQYDRCSQYIA-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.95
Rot. Bonds4

About N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methylbutanamide

N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methylbutanamide (PubChem CID 47861597) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methylbutanamide.

Molecular Properties

Compound NameN-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methylbutanamide
PubChem CID47861597
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC NameN-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methylbutanamide
SMILESCc1noc(C)c1CNC(=O)CC(C)C
InChIInChI=1S/C11H18N2O2/c1-7(2)5-11(14)12-6-10-8(3)13-15-9(10)4/h7H,5-6H2,1-4H3,(H,12,14)
InChIKeyFGMFQYDRCSQYIA-UHFFFAOYSA-N
XLogP1.95
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methylbutanamide 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-amino-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]propanamide
CID 79235982
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-(ethylamino)acetamide
CID 79236491
3-acetamido-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-phenylpropanamide
CID 75462228
2-chloro-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methylcarbamoyl]propanamide
CID 79238382
4-(2-aminoethyl)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5,5-dimethylhexanamide
CID 79231895
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-(4-methylpiperazin-1-yl)pentanamide
CID 91836065
(2S)-2-amino-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]butanamide
CID 79236085
3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-ethyl-1-methylurea
CID 115604567
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-[1-(methylamino)cyclohexyl]acetamide
CID 79236291
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide
CID 136665153
N-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2-oxoethyl]benzamide
CID 47935404
2-(aminomethyl)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]butanamide
CID 79236983

Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methylbutanamide?
The IUPAC name of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methylbutanamide (CID 47861597) is N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methylbutanamide.
What is the SMILES notation for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methylbutanamide?
The canonical SMILES for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methylbutanamide is Cc1noc(C)c1CNC(=O)CC(C)C.
What is the InChIKey of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methylbutanamide?
The InChIKey is FGMFQYDRCSQYIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-7(2)5-11(14)12-6-10-8(3)13-15-9(10)4/h7H,5-6H2,1-4H3,(H,12,14).
What are the key properties of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methylbutanamide?
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methylbutanamide has a molecular weight of 210.28 g/mol, XLogP of 1.95, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methylbutanamide is sourced from PubChem (CID 47861597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).