(2R)-N-[(5-butyl-1,2-oxazol-3-yl)methyl]-2,4-dihydroxy-3,3-dimethylbutanamide

C14H24N2O4 — CID 164617332

IUPAC(2R)-N-[(5-butyl-1,2-oxazol-3-yl)methyl]-2,4-dihydroxy-3,3-dimethylbutanamide
SMILESCCCCc1cc(CNC(=O)[C@H](O)C(C)(C)CO)no1
InChIInChI=1S/C14H24N2O4/c1-4-5-6-11-7-10(16-20-11)8-15-13(19)12(18)14(2,3)9-17/h7,12,17-18H,4-6,8-9H2,1-3H3,(H,15,19)/t12-/m0/s1
InChIKeyGAKSQZQLZFQSGH-LBPRGKRZSA-N
MW284.36 g/mol
LogP1.01
Rot. Bonds8

About (2R)-N-[(5-butyl-1,2-oxazol-3-yl)methyl]-2,4-dihydroxy-3,3-dimethylbutanamide

(2R)-N-[(5-butyl-1,2-oxazol-3-yl)methyl]-2,4-dihydroxy-3,3-dimethylbutanamide (PubChem CID 164617332) has the molecular formula C14H24N2O4 and a molecular weight of 284.36 g/mol. Its IUPAC name is (2R)-N-[(5-butyl-1,2-oxazol-3-yl)methyl]-2,4-dihydroxy-3,3-dimethylbutanamide.

Molecular Properties

Compound Name(2R)-N-[(5-butyl-1,2-oxazol-3-yl)methyl]-2,4-dihydroxy-3,3-dimethylbutanamide
PubChem CID164617332
Molecular FormulaC14H24N2O4
Molecular Weight284.36 g/mol
Exact Mass284.17
IUPAC Name(2R)-N-[(5-butyl-1,2-oxazol-3-yl)methyl]-2,4-dihydroxy-3,3-dimethylbutanamide
SMILESCCCCc1cc(CNC(=O)[C@H](O)C(C)(C)CO)no1
InChIInChI=1S/C14H24N2O4/c1-4-5-6-11-7-10(16-20-11)8-15-13(19)12(18)14(2,3)9-17/h7,12,17-18H,4-6,8-9H2,1-3H3,(H,15,19)/t12-/m0/s1
InChIKeyGAKSQZQLZFQSGH-LBPRGKRZSA-N
XLogP1.01
TPSA95.59 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(5-butyl-1,2-oxazol-3-yl)methyl]-2,4-dihydroxy-3,3-dimethylbutanamide?
The IUPAC name of (2R)-N-[(5-butyl-1,2-oxazol-3-yl)methyl]-2,4-dihydroxy-3,3-dimethylbutanamide (CID 164617332) is (2R)-N-[(5-butyl-1,2-oxazol-3-yl)methyl]-2,4-dihydroxy-3,3-dimethylbutanamide.
What is the SMILES notation for (2R)-N-[(5-butyl-1,2-oxazol-3-yl)methyl]-2,4-dihydroxy-3,3-dimethylbutanamide?
The canonical SMILES for (2R)-N-[(5-butyl-1,2-oxazol-3-yl)methyl]-2,4-dihydroxy-3,3-dimethylbutanamide is CCCCc1cc(CNC(=O)[C@H](O)C(C)(C)CO)no1.
What is the InChIKey of (2R)-N-[(5-butyl-1,2-oxazol-3-yl)methyl]-2,4-dihydroxy-3,3-dimethylbutanamide?
The InChIKey is GAKSQZQLZFQSGH-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H24N2O4/c1-4-5-6-11-7-10(16-20-11)8-15-13(19)12(18)14(2,3)9-17/h7,12,17-18H,4-6,8-9H2,1-3H3,(H,15,19)/t12-/m0/s1.
What are the key properties of (2R)-N-[(5-butyl-1,2-oxazol-3-yl)methyl]-2,4-dihydroxy-3,3-dimethylbutanamide?
(2R)-N-[(5-butyl-1,2-oxazol-3-yl)methyl]-2,4-dihydroxy-3,3-dimethylbutanamide has a molecular weight of 284.36 g/mol, XLogP of 1.01, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(5-butyl-1,2-oxazol-3-yl)methyl]-2,4-dihydroxy-3,3-dimethylbutanamide is sourced from PubChem (CID 164617332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).