N-cyclopropyl-5-(1-hydroxyethyl)-3-pyridin-3-yl-1,2-oxazole-4-carboxamide

C14H15N3O3 — CID 162800243

IUPACN-cyclopropyl-5-(1-hydroxyethyl)-3-pyridin-3-yl-1,2-oxazole-4-carboxamide
SMILESCC(O)c1onc(-c2cccnc2)c1C(=O)NC1CC1
InChIInChI=1S/C14H15N3O3/c1-8(18)13-11(14(19)16-10-4-5-10)12(17-20-13)9-3-2-6-15-7-9/h2-3,6-8,10,18H,4-5H2,1H3,(H,16,19)
InChIKeyRPZRULOLUKMYAD-UHFFFAOYSA-N
MW273.29 g/mol
LogP1.68
Rot. Bonds4

About N-cyclopropyl-5-(1-hydroxyethyl)-3-pyridin-3-yl-1,2-oxazole-4-carboxamide

N-cyclopropyl-5-(1-hydroxyethyl)-3-pyridin-3-yl-1,2-oxazole-4-carboxamide (PubChem CID 162800243) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is N-cyclopropyl-5-(1-hydroxyethyl)-3-pyridin-3-yl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-(1-hydroxyethyl)-3-pyridin-3-yl-1,2-oxazole-4-carboxamide
PubChem CID162800243
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC NameN-cyclopropyl-5-(1-hydroxyethyl)-3-pyridin-3-yl-1,2-oxazole-4-carboxamide
SMILESCC(O)c1onc(-c2cccnc2)c1C(=O)NC1CC1
InChIInChI=1S/C14H15N3O3/c1-8(18)13-11(14(19)16-10-4-5-10)12(17-20-13)9-3-2-6-15-7-9/h2-3,6-8,10,18H,4-5H2,1H3,(H,16,19)
InChIKeyRPZRULOLUKMYAD-UHFFFAOYSA-N
XLogP1.68
TPSA88.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-3-(4-fluorophenyl)-5-(1-hydroxyethyl)-1,2-oxazole-4-carboxamide
CID 162880928
[5-[(1S)-1-hydroxyethyl]-3-pyridin-3-yl-1,2-oxazol-4-yl]-pyrrolidin-1-ylmethanone
CID 124878355
5-amino-N-cyclobutyl-3-pyridin-3-yl-1,2-oxazole-4-carboxamide
CID 45087025
[5-(1-hydroxyethyl)-3-pyridin-3-yl-1,2-oxazol-4-yl]-morpholin-4-ylmethanone
CID 162800210
3-(4-chlorophenyl)-N-cyclopentyl-5-(1-hydroxyethyl)-1,2-oxazole-4-carboxamide
CID 162800200
3-(4-chlorophenyl)-N-cyclohexyl-5-(1-hydroxyethyl)-1,2-oxazole-4-carboxamide
CID 163091019
5-[(1R)-1-(cyclohexylcarbamoylamino)ethyl]-3-pyridin-3-yl-1,2-oxazole-4-carboxylic acid;hydrochloride
CID 146119660
5-(1-hydroxyethyl)-N-methyl-3-pyridin-3-yl-N-(pyridin-3-ylmethyl)-1,2-oxazole-4-carboxamide
CID 162800357
N-cyclohexyl-3-(3,4-dimethoxyphenyl)-5-(1-hydroxyethyl)-1,2-oxazole-4-carboxamide
CID 162793287
(4-benzylpiperazin-1-yl)-[5-(1-hydroxyethyl)-3-pyridin-3-yl-1,2-oxazol-4-yl]methanone
CID 162800298
(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[5-[(1S)-1-hydroxyethyl]-3-pyridin-3-yl-1,2-oxazol-4-yl]methanone
CID 124876643
5-[(1R)-1-(cyclopropylmethylamino)ethyl]-3-pyridin-3-yl-1,2-oxazole-4-carboxylic acid
CID 75368213

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-(1-hydroxyethyl)-3-pyridin-3-yl-1,2-oxazole-4-carboxamide?
The IUPAC name of N-cyclopropyl-5-(1-hydroxyethyl)-3-pyridin-3-yl-1,2-oxazole-4-carboxamide (CID 162800243) is N-cyclopropyl-5-(1-hydroxyethyl)-3-pyridin-3-yl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-(1-hydroxyethyl)-3-pyridin-3-yl-1,2-oxazole-4-carboxamide?
The canonical SMILES for N-cyclopropyl-5-(1-hydroxyethyl)-3-pyridin-3-yl-1,2-oxazole-4-carboxamide is CC(O)c1onc(-c2cccnc2)c1C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-5-(1-hydroxyethyl)-3-pyridin-3-yl-1,2-oxazole-4-carboxamide?
The InChIKey is RPZRULOLUKMYAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c1-8(18)13-11(14(19)16-10-4-5-10)12(17-20-13)9-3-2-6-15-7-9/h2-3,6-8,10,18H,4-5H2,1H3,(H,16,19).
What are the key properties of N-cyclopropyl-5-(1-hydroxyethyl)-3-pyridin-3-yl-1,2-oxazole-4-carboxamide?
N-cyclopropyl-5-(1-hydroxyethyl)-3-pyridin-3-yl-1,2-oxazole-4-carboxamide has a molecular weight of 273.29 g/mol, XLogP of 1.68, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-(1-hydroxyethyl)-3-pyridin-3-yl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 162800243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).