[1-(1,3-oxazol-2-yl)piperidin-4-yl]methanamine

C9H15N3O — CID 112709497

IUPAC[1-(1,3-oxazol-2-yl)piperidin-4-yl]methanamine
SMILESNCC1CCN(c2ncco2)CC1
InChIInChI=1S/C9H15N3O/c10-7-8-1-4-12(5-2-8)9-11-3-6-13-9/h3,6,8H,1-2,4-5,7,10H2
InChIKeyZFBKSBHXVJLOIU-UHFFFAOYSA-N
MW181.24 g/mol
LogP0.85
Rot. Bonds2

About [1-(1,3-oxazol-2-yl)piperidin-4-yl]methanamine

[1-(1,3-oxazol-2-yl)piperidin-4-yl]methanamine (PubChem CID 112709497) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is [1-(1,3-oxazol-2-yl)piperidin-4-yl]methanamine.

Molecular Properties

Compound Name[1-(1,3-oxazol-2-yl)piperidin-4-yl]methanamine
PubChem CID112709497
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name[1-(1,3-oxazol-2-yl)piperidin-4-yl]methanamine
SMILESNCC1CCN(c2ncco2)CC1
InChIInChI=1S/C9H15N3O/c10-7-8-1-4-12(5-2-8)9-11-3-6-13-9/h3,6,8H,1-2,4-5,7,10H2
InChIKeyZFBKSBHXVJLOIU-UHFFFAOYSA-N
XLogP0.85
TPSA55.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(2-methylpyrimidin-5-yl)piperidin-4-yl]methanamine
CID 83820134
[4-(1,3-oxazol-2-yl)cyclohexyl]methanamine
CID 82408869
(1-pyrazin-2-ylpiperidin-4-yl)methanamine;dihydrochloride
CID 56965638
2-[4-(aminomethyl)piperidin-1-yl]pyridin-3-ol
CID 71644858
[1-(1-methylimidazol-2-yl)piperidin-4-yl]methanamine
CID 62132388
(1-pyridin-2-ylpiperidin-4-yl)methanamine;dihydrochloride
CID 140971287
N-cyclopropyl-6-methyl-N-[1-(1,3-oxazol-2-yl)piperidin-4-yl]pyrimidin-4-amine
CID 126890697
4-N-cyclopropyl-6-N,6-N-dimethyl-4-N-[1-(1,3-oxazol-2-yl)piperidin-4-yl]pyrimidine-4,6-diamine
CID 126891615
[1-(1,3-benzoxazol-7-yl)piperidin-4-yl]methanamine
CID 96599592
[(3R)-1-(2-chloro-4-pyridinyl)pyrrolidin-3-yl]methanamine
CID 87263242
[1-(1,2,4-triazin-6-yl)piperidin-4-yl]methanamine
CID 112709666
[1-(3-methyltriazol-4-yl)piperidin-4-yl]methanamine
CID 130486423

Frequently Asked Questions

What is the IUPAC name of [1-(1,3-oxazol-2-yl)piperidin-4-yl]methanamine?
The IUPAC name of [1-(1,3-oxazol-2-yl)piperidin-4-yl]methanamine (CID 112709497) is [1-(1,3-oxazol-2-yl)piperidin-4-yl]methanamine.
What is the SMILES notation for [1-(1,3-oxazol-2-yl)piperidin-4-yl]methanamine?
The canonical SMILES for [1-(1,3-oxazol-2-yl)piperidin-4-yl]methanamine is NCC1CCN(c2ncco2)CC1.
What is the InChIKey of [1-(1,3-oxazol-2-yl)piperidin-4-yl]methanamine?
The InChIKey is ZFBKSBHXVJLOIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c10-7-8-1-4-12(5-2-8)9-11-3-6-13-9/h3,6,8H,1-2,4-5,7,10H2.
What are the key properties of [1-(1,3-oxazol-2-yl)piperidin-4-yl]methanamine?
[1-(1,3-oxazol-2-yl)piperidin-4-yl]methanamine has a molecular weight of 181.24 g/mol, XLogP of 0.85, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,3-oxazol-2-yl)piperidin-4-yl]methanamine is sourced from PubChem (CID 112709497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).