N,N-dicyclohexyl-5-methyl-1,2-oxazole-3-carboxamide

C17H26N2O2 — CID 3245758

IUPACN,N-dicyclohexyl-5-methyl-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(=O)N(C2CCCCC2)C2CCCCC2)no1
InChIInChI=1S/C17H26N2O2/c1-13-12-16(18-21-13)17(20)19(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h12,14-15H,2-11H2,1H3
InChIKeyACAPZKCRDPYIJW-UHFFFAOYSA-N
MW290.41 g/mol
LogP4.09
Rot. Bonds3

About N,N-dicyclohexyl-5-methyl-1,2-oxazole-3-carboxamide

N,N-dicyclohexyl-5-methyl-1,2-oxazole-3-carboxamide (PubChem CID 3245758) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N,N-dicyclohexyl-5-methyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN,N-dicyclohexyl-5-methyl-1,2-oxazole-3-carboxamide
PubChem CID3245758
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN,N-dicyclohexyl-5-methyl-1,2-oxazole-3-carboxamide
SMILESCc1cc(C(=O)N(C2CCCCC2)C2CCCCC2)no1
InChIInChI=1S/C17H26N2O2/c1-13-12-16(18-21-13)17(20)19(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h12,14-15H,2-11H2,1H3
InChIKeyACAPZKCRDPYIJW-UHFFFAOYSA-N
XLogP4.09
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dicyclohexyl-5-methyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N,N-dicyclohexyl-5-methyl-1,2-oxazole-3-carboxamide (CID 3245758) is N,N-dicyclohexyl-5-methyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N,N-dicyclohexyl-5-methyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N,N-dicyclohexyl-5-methyl-1,2-oxazole-3-carboxamide is Cc1cc(C(=O)N(C2CCCCC2)C2CCCCC2)no1.
What is the InChIKey of N,N-dicyclohexyl-5-methyl-1,2-oxazole-3-carboxamide?
The InChIKey is ACAPZKCRDPYIJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-13-12-16(18-21-13)17(20)19(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h12,14-15H,2-11H2,1H3.
What are the key properties of N,N-dicyclohexyl-5-methyl-1,2-oxazole-3-carboxamide?
N,N-dicyclohexyl-5-methyl-1,2-oxazole-3-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 4.09, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dicyclohexyl-5-methyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 3245758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).