N-(1,2-oxazol-3-yl)piperazine-1-carboxamide

C8H12N4O2 — CID 108811781

IUPACN-(1,2-oxazol-3-yl)piperazine-1-carboxamide
SMILESO=C(Nc1ccon1)N1CCNCC1
InChIInChI=1S/C8H12N4O2/c13-8(10-7-1-6-14-11-7)12-4-2-9-3-5-12/h1,6,9H,2-5H2,(H,10,11,13)
InChIKeyNITLEQGBYCESPT-UHFFFAOYSA-N
MW196.21 g/mol
LogP0.11
Rot. Bonds1

About N-(1,2-oxazol-3-yl)piperazine-1-carboxamide

N-(1,2-oxazol-3-yl)piperazine-1-carboxamide (PubChem CID 108811781) has the molecular formula C8H12N4O2 and a molecular weight of 196.21 g/mol. Its IUPAC name is N-(1,2-oxazol-3-yl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-(1,2-oxazol-3-yl)piperazine-1-carboxamide
PubChem CID108811781
Molecular FormulaC8H12N4O2
Molecular Weight196.21 g/mol
Exact Mass196.10
IUPAC NameN-(1,2-oxazol-3-yl)piperazine-1-carboxamide
SMILESO=C(Nc1ccon1)N1CCNCC1
InChIInChI=1S/C8H12N4O2/c13-8(10-7-1-6-14-11-7)12-4-2-9-3-5-12/h1,6,9H,2-5H2,(H,10,11,13)
InChIKeyNITLEQGBYCESPT-UHFFFAOYSA-N
XLogP0.11
TPSA70.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1,2-oxazol-3-yl)-2-piperazin-1-ylpropanamide
CID 62913788
4-(2,3-dimethylphenyl)-N-(1,2-oxazol-3-yl)piperazine-1-carboxamide
CID 108812009
N-(1,2-benzoxazol-3-yl)piperazine-1-carboxamide
CID 68724237
N-(1,2-oxazol-3-yl)pyrrolidine-2-carboxamide
CID 62902343
3-methyl-N-(1,2-oxazol-3-yl)piperidine-3-carboxamide
CID 63133042
N-(1-methylpyrrol-3-yl)piperazine-1-carboxamide
CID 82283727
4-(2-methyl-[1,2,4]triazolo[1,5-a]pyrazin-5-yl)-N-(1,2-oxazol-3-yl)piperazine-1-carboxamide
CID 129002357
(3S)-3-[methyl(pyrimidin-2-ylmethyl)amino]-N-(1,2-oxazol-3-yl)pyrrolidine-1-carboxamide
CID 129344240
(3S)-N-(1,2-oxazol-3-yl)piperidine-3-carboxamide
CID 81139342
N-(1H-pyrrol-3-yl)piperazine-1-carboxamide
CID 82281793
N-(4-iodophenyl)piperazine-1-carboxamide;hydrochloride
CID 165429741
N-(2,6-difluorophenyl)piperazine-1-carboxamide
CID 91552167

Frequently Asked Questions

What is the IUPAC name of N-(1,2-oxazol-3-yl)piperazine-1-carboxamide?
The IUPAC name of N-(1,2-oxazol-3-yl)piperazine-1-carboxamide (CID 108811781) is N-(1,2-oxazol-3-yl)piperazine-1-carboxamide.
What is the SMILES notation for N-(1,2-oxazol-3-yl)piperazine-1-carboxamide?
The canonical SMILES for N-(1,2-oxazol-3-yl)piperazine-1-carboxamide is O=C(Nc1ccon1)N1CCNCC1.
What is the InChIKey of N-(1,2-oxazol-3-yl)piperazine-1-carboxamide?
The InChIKey is NITLEQGBYCESPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O2/c13-8(10-7-1-6-14-11-7)12-4-2-9-3-5-12/h1,6,9H,2-5H2,(H,10,11,13).
What are the key properties of N-(1,2-oxazol-3-yl)piperazine-1-carboxamide?
N-(1,2-oxazol-3-yl)piperazine-1-carboxamide has a molecular weight of 196.21 g/mol, XLogP of 0.11, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-oxazol-3-yl)piperazine-1-carboxamide is sourced from PubChem (CID 108811781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).