oxolan-2-yl-(1-propylpyrazol-4-yl)methanamine

C11H19N3O — CID 65331147

IUPACoxolan-2-yl-(1-propylpyrazol-4-yl)methanamine
SMILESCCCn1cc(C(N)C2CCCO2)cn1
InChIInChI=1S/C11H19N3O/c1-2-5-14-8-9(7-13-14)11(12)10-4-3-6-15-10/h7-8,10-11H,2-6,12H2,1H3
InChIKeyHAMBCLFCCMNZIG-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.47
Rot. Bonds4

About oxolan-2-yl-(1-propylpyrazol-4-yl)methanamine

oxolan-2-yl-(1-propylpyrazol-4-yl)methanamine (PubChem CID 65331147) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is oxolan-2-yl-(1-propylpyrazol-4-yl)methanamine.

Molecular Properties

Compound Nameoxolan-2-yl-(1-propylpyrazol-4-yl)methanamine
PubChem CID65331147
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Nameoxolan-2-yl-(1-propylpyrazol-4-yl)methanamine
SMILESCCCn1cc(C(N)C2CCCO2)cn1
InChIInChI=1S/C11H19N3O/c1-2-5-14-8-9(7-13-14)11(12)10-4-3-6-15-10/h7-8,10-11H,2-6,12H2,1H3
InChIKeyHAMBCLFCCMNZIG-UHFFFAOYSA-N
XLogP1.47
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-methyloxolan-3-yl)-(1-propylpyrazol-4-yl)methanamine
CID 115808146
6-bicyclo[3.1.0]hexanyl-(1-propylpyrazol-4-yl)methanamine
CID 115807334
(1-propylpyrazol-4-yl)-[2-(trifluoromethyl)cyclohexyl]methanamine
CID 105103841
oxolan-2-yl-(1-propylimidazol-2-yl)methanamine
CID 65331088
cycloheptyl-(1-propylpyrazol-4-yl)methanol
CID 65398920
2-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl)-2-(1-propylpyrazol-4-yl)ethanamine
CID 103571823
3-(oxan-2-yl)-1-(1-propylpyrazol-4-yl)propan-1-ol
CID 114981610
(1,1-dioxothiolan-3-yl)-(1-propylpyrazol-4-yl)methanamine
CID 115336541
2-(oxolan-3-yl)-1-(1-propylpyrazol-4-yl)ethanamine
CID 103986856
(1-propylpyrazol-4-yl)-(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)methanamine
CID 105103598
(1-ethylpyrazol-4-yl)-(oxan-3-yl)methanamine
CID 65332290
oxolan-3-yl-(1-propylpyrazol-4-yl)methanol
CID 63893224

Frequently Asked Questions

What is the IUPAC name of oxolan-2-yl-(1-propylpyrazol-4-yl)methanamine?
The IUPAC name of oxolan-2-yl-(1-propylpyrazol-4-yl)methanamine (CID 65331147) is oxolan-2-yl-(1-propylpyrazol-4-yl)methanamine.
What is the SMILES notation for oxolan-2-yl-(1-propylpyrazol-4-yl)methanamine?
The canonical SMILES for oxolan-2-yl-(1-propylpyrazol-4-yl)methanamine is CCCn1cc(C(N)C2CCCO2)cn1.
What is the InChIKey of oxolan-2-yl-(1-propylpyrazol-4-yl)methanamine?
The InChIKey is HAMBCLFCCMNZIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-2-5-14-8-9(7-13-14)11(12)10-4-3-6-15-10/h7-8,10-11H,2-6,12H2,1H3.
What are the key properties of oxolan-2-yl-(1-propylpyrazol-4-yl)methanamine?
oxolan-2-yl-(1-propylpyrazol-4-yl)methanamine has a molecular weight of 209.29 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for oxolan-2-yl-(1-propylpyrazol-4-yl)methanamine is sourced from PubChem (CID 65331147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).