N-cycloheptyl-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide

C15H24N2O2 — CID 9268600

IUPACN-cycloheptyl-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide
SMILESCc1noc(C(C)C)c1C(=O)NC1CCCCCC1
InChIInChI=1S/C15H24N2O2/c1-10(2)14-13(11(3)17-19-14)15(18)16-12-8-6-4-5-7-9-12/h10,12H,4-9H2,1-3H3,(H,16,18)
InChIKeyGOVDWSMPBXEAMD-UHFFFAOYSA-N
MW264.37 g/mol
LogP3.56
Rot. Bonds3

About N-cycloheptyl-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide

N-cycloheptyl-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide (PubChem CID 9268600) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-cycloheptyl-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide
PubChem CID9268600
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-cycloheptyl-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide
SMILESCc1noc(C(C)C)c1C(=O)NC1CCCCCC1
InChIInChI=1S/C15H24N2O2/c1-10(2)14-13(11(3)17-19-14)15(18)16-12-8-6-4-5-7-9-12/h10,12H,4-9H2,1-3H3,(H,16,18)
InChIKeyGOVDWSMPBXEAMD-UHFFFAOYSA-N
XLogP3.56
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide?
The IUPAC name of N-cycloheptyl-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide (CID 9268600) is N-cycloheptyl-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for N-cycloheptyl-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide?
The canonical SMILES for N-cycloheptyl-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide is Cc1noc(C(C)C)c1C(=O)NC1CCCCCC1.
What is the InChIKey of N-cycloheptyl-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide?
The InChIKey is GOVDWSMPBXEAMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-10(2)14-13(11(3)17-19-14)15(18)16-12-8-6-4-5-7-9-12/h10,12H,4-9H2,1-3H3,(H,16,18).
What are the key properties of N-cycloheptyl-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide?
N-cycloheptyl-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 3.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 9268600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).