N-[(2R)-2-morpholin-4-yl-2-pyridin-4-ylethyl]-5-propyl-1,3,4-oxadiazol-2-amine

C16H23N5O2 — CID 97187543

IUPACN-[(2R)-2-morpholin-4-yl-2-pyridin-4-ylethyl]-5-propyl-1,3,4-oxadiazol-2-amine
SMILESCCCc1nnc(NC[C@@H](c2ccncc2)N2CCOCC2)o1
InChIInChI=1S/C16H23N5O2/c1-2-3-15-19-20-16(23-15)18-12-14(13-4-6-17-7-5-13)21-8-10-22-11-9-21/h4-7,14H,2-3,8-12H2,1H3,(H,18,20)/t14-/m0/s1
InChIKeyORDHKACVISWMPO-AWEZNQCLSA-N
MW317.39 g/mol
LogP1.90
Rot. Bonds7

About N-[(2R)-2-morpholin-4-yl-2-pyridin-4-ylethyl]-5-propyl-1,3,4-oxadiazol-2-amine

N-[(2R)-2-morpholin-4-yl-2-pyridin-4-ylethyl]-5-propyl-1,3,4-oxadiazol-2-amine (PubChem CID 97187543) has the molecular formula C16H23N5O2 and a molecular weight of 317.39 g/mol. Its IUPAC name is N-[(2R)-2-morpholin-4-yl-2-pyridin-4-ylethyl]-5-propyl-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound NameN-[(2R)-2-morpholin-4-yl-2-pyridin-4-ylethyl]-5-propyl-1,3,4-oxadiazol-2-amine
PubChem CID97187543
Molecular FormulaC16H23N5O2
Molecular Weight317.39 g/mol
Exact Mass317.19
IUPAC NameN-[(2R)-2-morpholin-4-yl-2-pyridin-4-ylethyl]-5-propyl-1,3,4-oxadiazol-2-amine
SMILESCCCc1nnc(NC[C@@H](c2ccncc2)N2CCOCC2)o1
InChIInChI=1S/C16H23N5O2/c1-2-3-15-19-20-16(23-15)18-12-14(13-4-6-17-7-5-13)21-8-10-22-11-9-21/h4-7,14H,2-3,8-12H2,1H3,(H,18,20)/t14-/m0/s1
InChIKeyORDHKACVISWMPO-AWEZNQCLSA-N
XLogP1.90
TPSA76.31 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-morpholin-4-yl-2-pyridin-4-ylethyl]-5-propyl-1,3,4-oxadiazol-2-amine?
The IUPAC name of N-[(2R)-2-morpholin-4-yl-2-pyridin-4-ylethyl]-5-propyl-1,3,4-oxadiazol-2-amine (CID 97187543) is N-[(2R)-2-morpholin-4-yl-2-pyridin-4-ylethyl]-5-propyl-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for N-[(2R)-2-morpholin-4-yl-2-pyridin-4-ylethyl]-5-propyl-1,3,4-oxadiazol-2-amine?
The canonical SMILES for N-[(2R)-2-morpholin-4-yl-2-pyridin-4-ylethyl]-5-propyl-1,3,4-oxadiazol-2-amine is CCCc1nnc(NC[C@@H](c2ccncc2)N2CCOCC2)o1.
What is the InChIKey of N-[(2R)-2-morpholin-4-yl-2-pyridin-4-ylethyl]-5-propyl-1,3,4-oxadiazol-2-amine?
The InChIKey is ORDHKACVISWMPO-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H23N5O2/c1-2-3-15-19-20-16(23-15)18-12-14(13-4-6-17-7-5-13)21-8-10-22-11-9-21/h4-7,14H,2-3,8-12H2,1H3,(H,18,20)/t14-/m0/s1.
What are the key properties of N-[(2R)-2-morpholin-4-yl-2-pyridin-4-ylethyl]-5-propyl-1,3,4-oxadiazol-2-amine?
N-[(2R)-2-morpholin-4-yl-2-pyridin-4-ylethyl]-5-propyl-1,3,4-oxadiazol-2-amine has a molecular weight of 317.39 g/mol, XLogP of 1.90, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-morpholin-4-yl-2-pyridin-4-ylethyl]-5-propyl-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 97187543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).