N,N-dicyclohexyl-5-propan-2-yl-1,2-oxazole-3-carboxamide

C19H30N2O2 — CID 17253281

IUPACN,N-dicyclohexyl-5-propan-2-yl-1,2-oxazole-3-carboxamide
SMILESCC(C)c1cc(C(=O)N(C2CCCCC2)C2CCCCC2)no1
InChIInChI=1S/C19H30N2O2/c1-14(2)18-13-17(20-23-18)19(22)21(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h13-16H,3-12H2,1-2H3
InChIKeyQTYPWWSCLAZZFG-UHFFFAOYSA-N
MW318.46 g/mol
LogP4.91
Rot. Bonds4

About N,N-dicyclohexyl-5-propan-2-yl-1,2-oxazole-3-carboxamide

N,N-dicyclohexyl-5-propan-2-yl-1,2-oxazole-3-carboxamide (PubChem CID 17253281) has the molecular formula C19H30N2O2 and a molecular weight of 318.46 g/mol. Its IUPAC name is N,N-dicyclohexyl-5-propan-2-yl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN,N-dicyclohexyl-5-propan-2-yl-1,2-oxazole-3-carboxamide
PubChem CID17253281
Molecular FormulaC19H30N2O2
Molecular Weight318.46 g/mol
Exact Mass318.23
IUPAC NameN,N-dicyclohexyl-5-propan-2-yl-1,2-oxazole-3-carboxamide
SMILESCC(C)c1cc(C(=O)N(C2CCCCC2)C2CCCCC2)no1
InChIInChI=1S/C19H30N2O2/c1-14(2)18-13-17(20-23-18)19(22)21(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h13-16H,3-12H2,1-2H3
InChIKeyQTYPWWSCLAZZFG-UHFFFAOYSA-N
XLogP4.91
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.46
LogP ≤ 54.91
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-propan-2-yl-1,2-oxazole-3-carboxamide?
The IUPAC name of N,N-dicyclohexyl-5-propan-2-yl-1,2-oxazole-3-carboxamide (CID 17253281) is N,N-dicyclohexyl-5-propan-2-yl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N,N-dicyclohexyl-5-propan-2-yl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N,N-dicyclohexyl-5-propan-2-yl-1,2-oxazole-3-carboxamide is CC(C)c1cc(C(=O)N(C2CCCCC2)C2CCCCC2)no1.
What is the InChIKey of N,N-dicyclohexyl-5-propan-2-yl-1,2-oxazole-3-carboxamide?
The InChIKey is QTYPWWSCLAZZFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O2/c1-14(2)18-13-17(20-23-18)19(22)21(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h13-16H,3-12H2,1-2H3.
What are the key properties of N,N-dicyclohexyl-5-propan-2-yl-1,2-oxazole-3-carboxamide?
N,N-dicyclohexyl-5-propan-2-yl-1,2-oxazole-3-carboxamide has a molecular weight of 318.46 g/mol, XLogP of 4.91, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dicyclohexyl-5-propan-2-yl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 17253281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).