N-[(1R)-1-cyclobutylethyl]-2-(cyclopropylmethyl)-4-methyl-1,3-oxazole-5-carboxamide

C15H22N2O2 — CID 124843351

IUPACN-[(1R)-1-cyclobutylethyl]-2-(cyclopropylmethyl)-4-methyl-1,3-oxazole-5-carboxamide
SMILESCc1nc(CC2CC2)oc1C(=O)N[C@H](C)C1CCC1
InChIInChI=1S/C15H22N2O2/c1-9(12-4-3-5-12)17-15(18)14-10(2)16-13(19-14)8-11-6-7-11/h9,11-12H,3-8H2,1-2H3,(H,17,18)/t9-/m1/s1
InChIKeyDONNDXSWSFPEGC-SECBINFHSA-N
MW262.35 g/mol
LogP2.85
Rot. Bonds5

About N-[(1R)-1-cyclobutylethyl]-2-(cyclopropylmethyl)-4-methyl-1,3-oxazole-5-carboxamide

N-[(1R)-1-cyclobutylethyl]-2-(cyclopropylmethyl)-4-methyl-1,3-oxazole-5-carboxamide (PubChem CID 124843351) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[(1R)-1-cyclobutylethyl]-2-(cyclopropylmethyl)-4-methyl-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-cyclobutylethyl]-2-(cyclopropylmethyl)-4-methyl-1,3-oxazole-5-carboxamide
PubChem CID124843351
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[(1R)-1-cyclobutylethyl]-2-(cyclopropylmethyl)-4-methyl-1,3-oxazole-5-carboxamide
SMILESCc1nc(CC2CC2)oc1C(=O)N[C@H](C)C1CCC1
InChIInChI=1S/C15H22N2O2/c1-9(12-4-3-5-12)17-15(18)14-10(2)16-13(19-14)8-11-6-7-11/h9,11-12H,3-8H2,1-2H3,(H,17,18)/t9-/m1/s1
InChIKeyDONNDXSWSFPEGC-SECBINFHSA-N
XLogP2.85
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-cyclobutylethyl]-2-(cyclopropylmethyl)-4-methyl-1,3-oxazole-5-carboxamide?
The IUPAC name of N-[(1R)-1-cyclobutylethyl]-2-(cyclopropylmethyl)-4-methyl-1,3-oxazole-5-carboxamide (CID 124843351) is N-[(1R)-1-cyclobutylethyl]-2-(cyclopropylmethyl)-4-methyl-1,3-oxazole-5-carboxamide.
What is the SMILES notation for N-[(1R)-1-cyclobutylethyl]-2-(cyclopropylmethyl)-4-methyl-1,3-oxazole-5-carboxamide?
The canonical SMILES for N-[(1R)-1-cyclobutylethyl]-2-(cyclopropylmethyl)-4-methyl-1,3-oxazole-5-carboxamide is Cc1nc(CC2CC2)oc1C(=O)N[C@H](C)C1CCC1.
What is the InChIKey of N-[(1R)-1-cyclobutylethyl]-2-(cyclopropylmethyl)-4-methyl-1,3-oxazole-5-carboxamide?
The InChIKey is DONNDXSWSFPEGC-SECBINFHSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-9(12-4-3-5-12)17-15(18)14-10(2)16-13(19-14)8-11-6-7-11/h9,11-12H,3-8H2,1-2H3,(H,17,18)/t9-/m1/s1.
What are the key properties of N-[(1R)-1-cyclobutylethyl]-2-(cyclopropylmethyl)-4-methyl-1,3-oxazole-5-carboxamide?
N-[(1R)-1-cyclobutylethyl]-2-(cyclopropylmethyl)-4-methyl-1,3-oxazole-5-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-cyclobutylethyl]-2-(cyclopropylmethyl)-4-methyl-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 124843351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).