3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-pyridin-2-yloxycyclohexyl)propanamide

C19H25N3O3 — CID 91625956

IUPAC3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-pyridin-2-yloxycyclohexyl)propanamide
SMILESCc1noc(C)c1CCC(=O)NC1CCC(Oc2ccccn2)CC1
InChIInChI=1S/C19H25N3O3/c1-13-17(14(2)25-22-13)10-11-18(23)21-15-6-8-16(9-7-15)24-19-5-3-4-12-20-19/h3-5,12,15-16H,6-11H2,1-2H3,(H,21,23)
InChIKeyLIOZCZKRCHPARG-UHFFFAOYSA-N
MW343.43 g/mol
LogP3.13
Rot. Bonds6

About 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-pyridin-2-yloxycyclohexyl)propanamide

3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-pyridin-2-yloxycyclohexyl)propanamide (PubChem CID 91625956) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-pyridin-2-yloxycyclohexyl)propanamide.

Molecular Properties

Compound Name3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-pyridin-2-yloxycyclohexyl)propanamide
PubChem CID91625956
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC Name3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-pyridin-2-yloxycyclohexyl)propanamide
SMILESCc1noc(C)c1CCC(=O)NC1CCC(Oc2ccccn2)CC1
InChIInChI=1S/C19H25N3O3/c1-13-17(14(2)25-22-13)10-11-18(23)21-15-6-8-16(9-7-15)24-19-5-3-4-12-20-19/h3-5,12,15-16H,6-11H2,1-2H3,(H,21,23)
InChIKeyLIOZCZKRCHPARG-UHFFFAOYSA-N
XLogP3.13
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-pyridin-2-yloxycyclohexyl)propanamide?
The IUPAC name of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-pyridin-2-yloxycyclohexyl)propanamide (CID 91625956) is 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-pyridin-2-yloxycyclohexyl)propanamide.
What is the SMILES notation for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-pyridin-2-yloxycyclohexyl)propanamide?
The canonical SMILES for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-pyridin-2-yloxycyclohexyl)propanamide is Cc1noc(C)c1CCC(=O)NC1CCC(Oc2ccccn2)CC1.
What is the InChIKey of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-pyridin-2-yloxycyclohexyl)propanamide?
The InChIKey is LIOZCZKRCHPARG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-13-17(14(2)25-22-13)10-11-18(23)21-15-6-8-16(9-7-15)24-19-5-3-4-12-20-19/h3-5,12,15-16H,6-11H2,1-2H3,(H,21,23).
What are the key properties of 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-pyridin-2-yloxycyclohexyl)propanamide?
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-pyridin-2-yloxycyclohexyl)propanamide has a molecular weight of 343.43 g/mol, XLogP of 3.13, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-pyridin-2-yloxycyclohexyl)propanamide is sourced from PubChem (CID 91625956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).