ethane;N-methyl-5-(1,2,4-oxadiazol-3-yl)pyridin-2-amine;pyrrolidine

C14H23N5O — CID 154660597

IUPACethane;N-methyl-5-(1,2,4-oxadiazol-3-yl)pyridin-2-amine;pyrrolidine
SMILESC1CCNC1.CC.CNc1ccc(-c2ncon2)cn1
InChIInChI=1S/C8H8N4O.C4H9N.C2H6/c1-9-7-3-2-6(4-10-7)8-11-5-13-12-8;1-2-4-5-3-1;1-2/h2-5H,1H3,(H,9,10);5H,1-4H2;1-2H3
InChIKeyAEZSOBPWPCTVQW-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.57
Rot. Bonds2

About ethane;N-methyl-5-(1,2,4-oxadiazol-3-yl)pyridin-2-amine;pyrrolidine

ethane;N-methyl-5-(1,2,4-oxadiazol-3-yl)pyridin-2-amine;pyrrolidine (PubChem CID 154660597) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is ethane;N-methyl-5-(1,2,4-oxadiazol-3-yl)pyridin-2-amine;pyrrolidine.

Molecular Properties

Compound Nameethane;N-methyl-5-(1,2,4-oxadiazol-3-yl)pyridin-2-amine;pyrrolidine
PubChem CID154660597
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Nameethane;N-methyl-5-(1,2,4-oxadiazol-3-yl)pyridin-2-amine;pyrrolidine
SMILESC1CCNC1.CC.CNc1ccc(-c2ncon2)cn1
InChIInChI=1S/C8H8N4O.C4H9N.C2H6/c1-9-7-3-2-6(4-10-7)8-11-5-13-12-8;1-2-4-5-3-1;1-2/h2-5H,1H3,(H,9,10);5H,1-4H2;1-2H3
InChIKeyAEZSOBPWPCTVQW-UHFFFAOYSA-N
XLogP2.57
TPSA75.87 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of ethane;N-methyl-5-(1,2,4-oxadiazol-3-yl)pyridin-2-amine;pyrrolidine?
The IUPAC name of ethane;N-methyl-5-(1,2,4-oxadiazol-3-yl)pyridin-2-amine;pyrrolidine (CID 154660597) is ethane;N-methyl-5-(1,2,4-oxadiazol-3-yl)pyridin-2-amine;pyrrolidine.
What is the SMILES notation for ethane;N-methyl-5-(1,2,4-oxadiazol-3-yl)pyridin-2-amine;pyrrolidine?
The canonical SMILES for ethane;N-methyl-5-(1,2,4-oxadiazol-3-yl)pyridin-2-amine;pyrrolidine is C1CCNC1.CC.CNc1ccc(-c2ncon2)cn1.
What is the InChIKey of ethane;N-methyl-5-(1,2,4-oxadiazol-3-yl)pyridin-2-amine;pyrrolidine?
The InChIKey is AEZSOBPWPCTVQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O.C4H9N.C2H6/c1-9-7-3-2-6(4-10-7)8-11-5-13-12-8;1-2-4-5-3-1;1-2/h2-5H,1H3,(H,9,10);5H,1-4H2;1-2H3.
What are the key properties of ethane;N-methyl-5-(1,2,4-oxadiazol-3-yl)pyridin-2-amine;pyrrolidine?
ethane;N-methyl-5-(1,2,4-oxadiazol-3-yl)pyridin-2-amine;pyrrolidine has a molecular weight of 277.37 g/mol, XLogP of 2.57, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methyl-5-(1,2,4-oxadiazol-3-yl)pyridin-2-amine;pyrrolidine is sourced from PubChem (CID 154660597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).