6-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylheptanamide

C14H25N3O2 — CID 106371015

IUPAC6-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylheptanamide
SMILESCCc1cnc(CNC(=O)C(C)CCCC(C)N)o1
InChIInChI=1S/C14H25N3O2/c1-4-12-8-16-13(19-12)9-17-14(18)10(2)6-5-7-11(3)15/h8,10-11H,4-7,9,15H2,1-3H3,(H,17,18)
InChIKeyKAFYHXTVIPYBNJ-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.01
Rot. Bonds8

About 6-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylheptanamide

6-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylheptanamide (PubChem CID 106371015) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is 6-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylheptanamide.

Molecular Properties

Compound Name6-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylheptanamide
PubChem CID106371015
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC Name6-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylheptanamide
SMILESCCc1cnc(CNC(=O)C(C)CCCC(C)N)o1
InChIInChI=1S/C14H25N3O2/c1-4-12-8-16-13(19-12)9-17-14(18)10(2)6-5-7-11(3)15/h8,10-11H,4-7,9,15H2,1-3H3,(H,17,18)
InChIKeyKAFYHXTVIPYBNJ-UHFFFAOYSA-N
XLogP2.01
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylbutanamide
CID 106370868
(2S)-2-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]propanamide
CID 106371001
2-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3,3-dimethylbutanamide
CID 106370818
4-amino-5-[(5-ethyl-1,3-oxazol-2-yl)methylamino]-5-oxopentanoic acid
CID 106371131
2-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butanediamide
CID 106370829
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-methyl-2-sulfanylbutanamide
CID 106377749
4-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-4-phenylbutanamide
CID 106370852
ethyl 2-[(5-ethyl-1,3-oxazol-2-yl)methylamino]butanoate
CID 106371541
methyl 3-[(5-ethyl-1,3-oxazol-2-yl)methylamino]-2-methylpropanoate
CID 106371286
2-[(5-ethyl-1,3-oxazol-2-yl)methylamino]butanamide
CID 106371196
2-amino-2-ethyl-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]butanamide
CID 106370796
2-[(5-ethyl-1,3-oxazol-2-yl)methylcarbamoylamino]butanoic acid
CID 106374246

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylheptanamide?
The IUPAC name of 6-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylheptanamide (CID 106371015) is 6-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylheptanamide.
What is the SMILES notation for 6-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylheptanamide?
The canonical SMILES for 6-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylheptanamide is CCc1cnc(CNC(=O)C(C)CCCC(C)N)o1.
What is the InChIKey of 6-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylheptanamide?
The InChIKey is KAFYHXTVIPYBNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-4-12-8-16-13(19-12)9-17-14(18)10(2)6-5-7-11(3)15/h8,10-11H,4-7,9,15H2,1-3H3,(H,17,18).
What are the key properties of 6-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylheptanamide?
6-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylheptanamide has a molecular weight of 267.37 g/mol, XLogP of 2.01, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-2-methylheptanamide is sourced from PubChem (CID 106371015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).