N-[[(2R)-4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine

C17H24N6O2 — CID 97028617

IUPACN-[[(2R)-4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine
SMILESCCN(C[C@H]1CN(Cc2nnc(C3CC3)o2)CCO1)c1cccnn1
InChIInChI=1S/C17H24N6O2/c1-2-23(15-4-3-7-18-19-15)11-14-10-22(8-9-24-14)12-16-20-21-17(25-16)13-5-6-13/h3-4,7,13-14H,2,5-6,8-12H2,1H3/t14-/m1/s1
InChIKeyCLEKEKWCOSMPBL-CQSZACIVSA-N
MW344.42 g/mol
LogP1.46
Rot. Bonds7

About N-[[(2R)-4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine

N-[[(2R)-4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine (PubChem CID 97028617) has the molecular formula C17H24N6O2 and a molecular weight of 344.42 g/mol. Its IUPAC name is N-[[(2R)-4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine.

Molecular Properties

Compound NameN-[[(2R)-4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine
PubChem CID97028617
Molecular FormulaC17H24N6O2
Molecular Weight344.42 g/mol
Exact Mass344.20
IUPAC NameN-[[(2R)-4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine
SMILESCCN(C[C@H]1CN(Cc2nnc(C3CC3)o2)CCO1)c1cccnn1
InChIInChI=1S/C17H24N6O2/c1-2-23(15-4-3-7-18-19-15)11-14-10-22(8-9-24-14)12-16-20-21-17(25-16)13-5-6-13/h3-4,7,13-14H,2,5-6,8-12H2,1H3/t14-/m1/s1
InChIKeyCLEKEKWCOSMPBL-CQSZACIVSA-N
XLogP1.46
TPSA80.41 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-[[(2R)-4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine?
The IUPAC name of N-[[(2R)-4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine (CID 97028617) is N-[[(2R)-4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine.
What is the SMILES notation for N-[[(2R)-4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine?
The canonical SMILES for N-[[(2R)-4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine is CCN(C[C@H]1CN(Cc2nnc(C3CC3)o2)CCO1)c1cccnn1.
What is the InChIKey of N-[[(2R)-4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine?
The InChIKey is CLEKEKWCOSMPBL-CQSZACIVSA-N. The full InChI is InChI=1S/C17H24N6O2/c1-2-23(15-4-3-7-18-19-15)11-14-10-22(8-9-24-14)12-16-20-21-17(25-16)13-5-6-13/h3-4,7,13-14H,2,5-6,8-12H2,1H3/t14-/m1/s1.
What are the key properties of N-[[(2R)-4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine?
N-[[(2R)-4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine has a molecular weight of 344.42 g/mol, XLogP of 1.46, 7 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2R)-4-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine is sourced from PubChem (CID 97028617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).