4-(5-methyl-1,3-oxazol-2-yl)piperazin-1-amine

C8H14N4O — CID 123445469

IUPAC4-(5-methyl-1,3-oxazol-2-yl)piperazin-1-amine
SMILESCc1cnc(N2CCN(N)CC2)o1
InChIInChI=1S/C8H14N4O/c1-7-6-10-8(13-7)11-2-4-12(9)5-3-11/h6H,2-5,9H2,1H3
InChIKeyDTFOQBPNTOVOPG-UHFFFAOYSA-N
MW182.23 g/mol
LogP-0.02
Rot. Bonds1

About 4-(5-methyl-1,3-oxazol-2-yl)piperazin-1-amine

4-(5-methyl-1,3-oxazol-2-yl)piperazin-1-amine (PubChem CID 123445469) has the molecular formula C8H14N4O and a molecular weight of 182.23 g/mol. Its IUPAC name is 4-(5-methyl-1,3-oxazol-2-yl)piperazin-1-amine.

Molecular Properties

Compound Name4-(5-methyl-1,3-oxazol-2-yl)piperazin-1-amine
PubChem CID123445469
Molecular FormulaC8H14N4O
Molecular Weight182.23 g/mol
Exact Mass182.12
IUPAC Name4-(5-methyl-1,3-oxazol-2-yl)piperazin-1-amine
SMILESCc1cnc(N2CCN(N)CC2)o1
InChIInChI=1S/C8H14N4O/c1-7-6-10-8(13-7)11-2-4-12(9)5-3-11/h6H,2-5,9H2,1H3
InChIKeyDTFOQBPNTOVOPG-UHFFFAOYSA-N
XLogP-0.02
TPSA58.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Related Compounds

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CID 142165638
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CID 148676209
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CID 155046165
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CID 155046166
CID 155046166
CID 168264365
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CID 169954743
CID 169954743

Frequently Asked Questions

What is the IUPAC name of 4-(5-methyl-1,3-oxazol-2-yl)piperazin-1-amine?
The IUPAC name of 4-(5-methyl-1,3-oxazol-2-yl)piperazin-1-amine (CID 123445469) is 4-(5-methyl-1,3-oxazol-2-yl)piperazin-1-amine.
What is the SMILES notation for 4-(5-methyl-1,3-oxazol-2-yl)piperazin-1-amine?
The canonical SMILES for 4-(5-methyl-1,3-oxazol-2-yl)piperazin-1-amine is Cc1cnc(N2CCN(N)CC2)o1.
What is the InChIKey of 4-(5-methyl-1,3-oxazol-2-yl)piperazin-1-amine?
The InChIKey is DTFOQBPNTOVOPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O/c1-7-6-10-8(13-7)11-2-4-12(9)5-3-11/h6H,2-5,9H2,1H3.
What are the key properties of 4-(5-methyl-1,3-oxazol-2-yl)piperazin-1-amine?
4-(5-methyl-1,3-oxazol-2-yl)piperazin-1-amine has a molecular weight of 182.23 g/mol, XLogP of -0.02, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methyl-1,3-oxazol-2-yl)piperazin-1-amine is sourced from PubChem (CID 123445469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).