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

C19H30N2O2 — CID 5309153

IUPACN,N-dicyclohexyl-5-propyl-1,2-oxazole-3-carboxamide
SMILESCCCc1cc(C(=O)N(C2CCCCC2)C2CCCCC2)no1
InChIInChI=1S/C19H30N2O2/c1-2-9-17-14-18(20-23-17)19(22)21(15-10-5-3-6-11-15)16-12-7-4-8-13-16/h14-16H,2-13H2,1H3
InChIKeyXTUSMJNHGPASSE-UHFFFAOYSA-N
MW318.46 g/mol
LogP4.73
Rot. Bonds5

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

N,N-dicyclohexyl-5-propyl-1,2-oxazole-3-carboxamide (PubChem CID 5309153) has the molecular formula C19H30N2O2 and a molecular weight of 318.46 g/mol. Its IUPAC name is N,N-dicyclohexyl-5-propyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN,N-dicyclohexyl-5-propyl-1,2-oxazole-3-carboxamide
PubChem CID5309153
Molecular FormulaC19H30N2O2
Molecular Weight318.46 g/mol
Exact Mass318.23
IUPAC NameN,N-dicyclohexyl-5-propyl-1,2-oxazole-3-carboxamide
SMILESCCCc1cc(C(=O)N(C2CCCCC2)C2CCCCC2)no1
InChIInChI=1S/C19H30N2O2/c1-2-9-17-14-18(20-23-17)19(22)21(15-10-5-3-6-11-15)16-12-7-4-8-13-16/h14-16H,2-13H2,1H3
InChIKeyXTUSMJNHGPASSE-UHFFFAOYSA-N
XLogP4.73
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.46
LogP ≤ 54.73
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-propyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N,N-dicyclohexyl-5-propyl-1,2-oxazole-3-carboxamide (CID 5309153) is N,N-dicyclohexyl-5-propyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N,N-dicyclohexyl-5-propyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N,N-dicyclohexyl-5-propyl-1,2-oxazole-3-carboxamide is CCCc1cc(C(=O)N(C2CCCCC2)C2CCCCC2)no1.
What is the InChIKey of N,N-dicyclohexyl-5-propyl-1,2-oxazole-3-carboxamide?
The InChIKey is XTUSMJNHGPASSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O2/c1-2-9-17-14-18(20-23-17)19(22)21(15-10-5-3-6-11-15)16-12-7-4-8-13-16/h14-16H,2-13H2,1H3.
What are the key properties of N,N-dicyclohexyl-5-propyl-1,2-oxazole-3-carboxamide?
N,N-dicyclohexyl-5-propyl-1,2-oxazole-3-carboxamide has a molecular weight of 318.46 g/mol, XLogP of 4.73, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dicyclohexyl-5-propyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 5309153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).