5-cyclopropyl-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]-1,3,4-oxadiazol-2-amine

C16H17N5O — CID 97122258

IUPAC5-cyclopropyl-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]-1,3,4-oxadiazol-2-amine
SMILESc1ccc([C@H](Cn2cccn2)Nc2nnc(C3CC3)o2)cc1
InChIInChI=1S/C16H17N5O/c1-2-5-12(6-3-1)14(11-21-10-4-9-17-21)18-16-20-19-15(22-16)13-7-8-13/h1-6,9-10,13-14H,7-8,11H2,(H,18,20)/t14-/m0/s1
InChIKeyHYXJYGWCVLBKLE-AWEZNQCLSA-N
MW295.35 g/mol
LogP3.00
Rot. Bonds6

About 5-cyclopropyl-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]-1,3,4-oxadiazol-2-amine

5-cyclopropyl-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]-1,3,4-oxadiazol-2-amine (PubChem CID 97122258) has the molecular formula C16H17N5O and a molecular weight of 295.35 g/mol. Its IUPAC name is 5-cyclopropyl-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound Name5-cyclopropyl-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]-1,3,4-oxadiazol-2-amine
PubChem CID97122258
Molecular FormulaC16H17N5O
Molecular Weight295.35 g/mol
Exact Mass295.14
IUPAC Name5-cyclopropyl-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]-1,3,4-oxadiazol-2-amine
SMILESc1ccc([C@H](Cn2cccn2)Nc2nnc(C3CC3)o2)cc1
InChIInChI=1S/C16H17N5O/c1-2-5-12(6-3-1)14(11-21-10-4-9-17-21)18-16-20-19-15(22-16)13-7-8-13/h1-6,9-10,13-14H,7-8,11H2,(H,18,20)/t14-/m0/s1
InChIKeyHYXJYGWCVLBKLE-AWEZNQCLSA-N
XLogP3.00
TPSA68.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-cyclopropyl-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]-1,3,4-oxadiazol-2-amine with MolForge

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Related Compounds

5-cyclopropyl-N-(1-phenyl-2-pyrazol-1-ylethyl)-1,3,4-oxadiazol-2-amine
CID 72867117
5-chloro-N-(1-phenyl-2-pyrazol-1-ylethyl)pyrimidin-2-amine
CID 75376384
N-(1-phenyl-2-pyrazol-1-ylethyl)-1,4-dithiepan-6-amine
CID 131946378
N-(1-phenyl-2-pyrazol-1-ylethyl)-3-pyrazol-1-ylpropan-1-amine
CID 131952072
5-cyclobutyl-N-[(1S)-2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]-1,3,4-oxadiazol-2-amine
CID 97188149
(1R)-1-phenyl-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]propan-1-amine
CID 93276656
2-(2-aminoethyl)-N-(1-phenyl-2-pyrazol-1-ylethyl)quinazolin-4-amine
CID 50980828
2-(2-aminoethyl)-N-[(1S)-1-phenyl-2-pyrazol-1-ylethyl]quinazolin-4-amine
CID 95144128
1-[[(1S,2R)-2-hydroxycyclopentyl]methyl]-1-methyl-3-[(1S)-1-phenyl-2-pyrazol-1-ylethyl]urea
CID 98874250
5-[(cyclopropylamino)methyl]-N-(1-phenylpropyl)-1,3,4-oxadiazol-2-amine
CID 106960357
N-(1-phenyl-2-pyrazol-1-ylethyl)prop-2-enamide
CID 166406989
(1R)-1-phenyl-2-pyrazol-1-ylethanol
CID 712326

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]-1,3,4-oxadiazol-2-amine?
The IUPAC name of 5-cyclopropyl-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]-1,3,4-oxadiazol-2-amine (CID 97122258) is 5-cyclopropyl-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for 5-cyclopropyl-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]-1,3,4-oxadiazol-2-amine?
The canonical SMILES for 5-cyclopropyl-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]-1,3,4-oxadiazol-2-amine is c1ccc([C@H](Cn2cccn2)Nc2nnc(C3CC3)o2)cc1.
What is the InChIKey of 5-cyclopropyl-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]-1,3,4-oxadiazol-2-amine?
The InChIKey is HYXJYGWCVLBKLE-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H17N5O/c1-2-5-12(6-3-1)14(11-21-10-4-9-17-21)18-16-20-19-15(22-16)13-7-8-13/h1-6,9-10,13-14H,7-8,11H2,(H,18,20)/t14-/m0/s1.
What are the key properties of 5-cyclopropyl-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]-1,3,4-oxadiazol-2-amine?
5-cyclopropyl-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]-1,3,4-oxadiazol-2-amine has a molecular weight of 295.35 g/mol, XLogP of 3.00, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-[(1R)-1-phenyl-2-pyrazol-1-ylethyl]-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 97122258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).