N-(4,5-dimethyl-1,3-oxazol-2-yl)-4-(2-hydroxyethyl)piperazine-1-carboxamide

C12H20N4O3 — CID 110923496

IUPACN-(4,5-dimethyl-1,3-oxazol-2-yl)-4-(2-hydroxyethyl)piperazine-1-carboxamide
SMILESCc1nc(NC(=O)N2CCN(CCO)CC2)oc1C
InChIInChI=1S/C12H20N4O3/c1-9-10(2)19-11(13-9)14-12(18)16-5-3-15(4-6-16)7-8-17/h17H,3-8H2,1-2H3,(H,13,14,18)
InChIKeyLEDPKUHFQZBSLW-UHFFFAOYSA-N
MW268.32 g/mol
LogP0.43
Rot. Bonds3

About N-(4,5-dimethyl-1,3-oxazol-2-yl)-4-(2-hydroxyethyl)piperazine-1-carboxamide

N-(4,5-dimethyl-1,3-oxazol-2-yl)-4-(2-hydroxyethyl)piperazine-1-carboxamide (PubChem CID 110923496) has the molecular formula C12H20N4O3 and a molecular weight of 268.32 g/mol. Its IUPAC name is N-(4,5-dimethyl-1,3-oxazol-2-yl)-4-(2-hydroxyethyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-1,3-oxazol-2-yl)-4-(2-hydroxyethyl)piperazine-1-carboxamide
PubChem CID110923496
Molecular FormulaC12H20N4O3
Molecular Weight268.32 g/mol
Exact Mass268.15
IUPAC NameN-(4,5-dimethyl-1,3-oxazol-2-yl)-4-(2-hydroxyethyl)piperazine-1-carboxamide
SMILESCc1nc(NC(=O)N2CCN(CCO)CC2)oc1C
InChIInChI=1S/C12H20N4O3/c1-9-10(2)19-11(13-9)14-12(18)16-5-3-15(4-6-16)7-8-17/h17H,3-8H2,1-2H3,(H,13,14,18)
InChIKeyLEDPKUHFQZBSLW-UHFFFAOYSA-N
XLogP0.43
TPSA81.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4,5-dimethyl-1,3-oxazol-2-yl)-4-(4,5-dimethyl-1,3-thiazol-2-yl)piperazine-1-carboxamide
CID 71844308
N-(3,5-dihydroxyphenyl)-4-(2-hydroxyethyl)piperazine-1-carboxamide
CID 108895469
4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-N-thiophen-3-ylpiperazine-1-carboxamide
CID 75438160
4-(2-hydroxyethyl)-N-propan-2-ylpiperazine-1-carboxamide
CID 43501412
4-[6-[4-(2-hydroxyethyl)piperazin-1-yl]pyridazin-3-yl]-N-(4-methylphenyl)piperazine-1-carboxamide
CID 122336600
N-(3,5-dimethoxyphenyl)-4-(2-hydroxyethyl)piperazine-1-carboxamide
CID 108869457
N-(2,6-dimethoxyphenyl)-4-(2-hydroxyethyl)piperazine-1-carboxamide
CID 108867927
4-[[4-(2-hydroxyethyl)piperazine-1-carbonyl]amino]benzoic acid
CID 61202930
N-(4-fluorophenyl)-4-(2-hydroxyethyl)piperazine-1-carboxamide
CID 3030092
1-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone
CID 4739629
4-(2-hydroxyethyl)-N-(2-methoxyethyl)piperazine-1-carboxamide
CID 108890532
4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-N-(5-ethyl-1,3-thiazol-2-yl)piperazine-1-carboxamide
CID 75435311

Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-1,3-oxazol-2-yl)-4-(2-hydroxyethyl)piperazine-1-carboxamide?
The IUPAC name of N-(4,5-dimethyl-1,3-oxazol-2-yl)-4-(2-hydroxyethyl)piperazine-1-carboxamide (CID 110923496) is N-(4,5-dimethyl-1,3-oxazol-2-yl)-4-(2-hydroxyethyl)piperazine-1-carboxamide.
What is the SMILES notation for N-(4,5-dimethyl-1,3-oxazol-2-yl)-4-(2-hydroxyethyl)piperazine-1-carboxamide?
The canonical SMILES for N-(4,5-dimethyl-1,3-oxazol-2-yl)-4-(2-hydroxyethyl)piperazine-1-carboxamide is Cc1nc(NC(=O)N2CCN(CCO)CC2)oc1C.
What is the InChIKey of N-(4,5-dimethyl-1,3-oxazol-2-yl)-4-(2-hydroxyethyl)piperazine-1-carboxamide?
The InChIKey is LEDPKUHFQZBSLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O3/c1-9-10(2)19-11(13-9)14-12(18)16-5-3-15(4-6-16)7-8-17/h17H,3-8H2,1-2H3,(H,13,14,18).
What are the key properties of N-(4,5-dimethyl-1,3-oxazol-2-yl)-4-(2-hydroxyethyl)piperazine-1-carboxamide?
N-(4,5-dimethyl-1,3-oxazol-2-yl)-4-(2-hydroxyethyl)piperazine-1-carboxamide has a molecular weight of 268.32 g/mol, XLogP of 0.43, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethyl-1,3-oxazol-2-yl)-4-(2-hydroxyethyl)piperazine-1-carboxamide is sourced from PubChem (CID 110923496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).